SCHEMBL1043531

SCHEMBL1043531

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@H]2CC[C@]2(C)C(=O)CC(O)[C@@H]12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SHBG P04278 6/20 0.64
▸ LMNA P02545 6/20 0.64
▸ HSD17B10 Q99714 6/20 0.64
▸ SMN1; SMN2 Q16637 6/20 0.64
▸ ALDH1A1 P00352 5/20 0.64
▸ TSHR P16473 5/20 0.64
▸ SERPINA6 P08185 4/20 0.64
▸ CYP19A1 P11511 4/20 0.64
▸ SNCA P37840 4/20 0.64
▸ MAPK1 P28482 4/20 0.64
▸ BLM P54132 3/20 0.64
▸ PMP22 Q01453 3/20 0.64
▸ NPSR1 Q6W5P4 3/20 0.64
▸ HSD17B3 P37058 2/20 0.64
▸ NR3C1 P04150 5/20 0.61
▸ PGR P06401 5/20 0.61
▸ CYP3A4 P08684 4/20 0.61
▸ AR P10275 4/20 0.61
▸ MAPT P10636 3/20 0.61
▸ CACNA1C Q13936 2/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1421984 1.00 SHBG (0.64) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL1043530 1.00 SHBG (0.64) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL12957827 1.00 SHBG (0.64) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL13356032 1.00 SHBG (0.64) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL10698509 0.86 SMN1; SMN2 (0.66) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL8646615 0.86 SMN1; SMN2 (0.66) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL8646618 0.86 SMN1; SMN2 (0.66) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL29504095 0.85 SMN1; SMN2 (0.59) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL10698335 0.84 HSD17B10 (0.60) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL10698341 0.84 HSD17B10 (0.60) SHBGLMNAHSD17B10SMN1; SMN2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450476-B2 Making drospirenone; chemical intermediates e.g. carbethoxy-drospirenone; industrial scale, safe (no chromium catalyst), meets purity requirements RICHTER GEDEON NYRT. (HU) 2013-05-28 — — US claimed
US-8309712-B2 Synthesis of drospirenone in only eight steps; claimed intermediates; readily available raw materials; simple crystallization purification; no hazardous materials; yield RICHTER GEDEON NYRT. (HU) 2012-11-13 — — US claimed
WO-2011000535-A2 METHOD FOR PRODUCING DROSPIRENONE HEYL CHEMISCH-PHARMAZEUTISCHE FABRIK GMBH & CO. K (DE) 2011-01-06 — — WO claimed
EP-1817326-B1 INDUSTRIAL PROCESS FOR THE PREPERATION OF 17-HYDROXY -6 BETA, 7-BETA, 15-BETA, 16-BETA-BISMETHYLENE-3-OXO 17-ALPHA PREGN-4-ENE-21-CARBOXYLIC ACID GAMMA-LACTONE AND KEY INTERMEDIATES FOR THIS PROCESS RICHTER GEDEON NYRT (HU) 2010-05-19 — — EP claimed
EP-1831239-B1 A PROCESS FOR THE PREPARATION OF 17-HYDROXY-6 BETA, 7 BETA, 15 BETA, 16 BETA -BISMETHYLENE-17 ALPHA-PREGN-4-ENE-3-ONE-21-CARBOXYLIC ACID LAMBDA-LACTONE AND KEY-INTERMEDIATES FOR THIS PROCESS RICHTER GEDEON NYRT (HU) 2010-03-24 — — EP claimed
US-20080200668-A1 Industrial Process for the Preparation of 17-Hydroxy-6Beta, 7Beta; 15Beta, 16Beta-Bismethylene-3-Oxo-17Alpha-Pregn-4-Ene-21-Carboxylic Acid Y-Lactone and Key Intermediates for this Process RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-08-21 — — US claimed
US-20080194812-A1 Process for the Preparation of 17-Hydroxy-6Beta, 7Beta; 15Beta, 16Beta-Bismethylene- 17Alpha-Pregn-4-Ene-3-One-21-Carboxylic Acid Y-Lactone and Key Intermediates for this Process RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-08-14 — — US claimed
EP-1817326-A1 INDUSTRIAL PROCESS FOR THE PREPERATION OF 17-HYDROXY -6 BETA, 7-BETA, 15-BETA, 16-BETA-BISMETHYLENE-3-OXO 17-ALPHA PREGN-4-ENE-21-CARBOXYLIC ACID GAMMA-LACTONE AND KEY INTERMEDIATES FOR THIS PROCESS Richter Gedeon Vegy Szeti Gy R Rt. (HU) 2007-08-15 — — EP claimed
WO-2006059167-A1 INDUSTRIAL PROCESS FOR THE PREPARATION OF 17-HYDROXY-6β,7β;15β,16β-BISMETHYLENE-3-OXO-17α-PREGN-4-ENE-21-CARBOXYLIC ACID Ϝ-LACTONE AND KEY-INTERMEDIATES FOR THIS PROCESS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2006-06-08 — — WO claimed
US-8450476-B2 Making drospirenone; chemical intermediates e.g. carbethoxy-drospirenone; industrial scale, safe (no chromium catalyst), meets purity requirements RICHTER GEDEON NYRT. (HU) 2013-05-28 — — US disclosed
US-8309712-B2 Synthesis of drospirenone in only eight steps; claimed intermediates; readily available raw materials; simple crystallization purification; no hazardous materials; yield RICHTER GEDEON NYRT. (HU) 2012-11-13 — — US disclosed
EP-2069382-B1 PROCESS FOR THE SELECTIVE ISOLATION, PURIFICATION AND SEPARATION OF MONOHYDROXYLATED 3,17-DIKETO-STEROID COMPOUNDS RICHTER GEDEON NYRT (HU) 2011-03-23 — — EP disclosed
EP-1817326-B1 INDUSTRIAL PROCESS FOR THE PREPERATION OF 17-HYDROXY -6 BETA, 7-BETA, 15-BETA, 16-BETA-BISMETHYLENE-3-OXO 17-ALPHA PREGN-4-ENE-21-CARBOXYLIC ACID GAMMA-LACTONE AND KEY INTERMEDIATES FOR THIS PROCESS RICHTER GEDEON NYRT (HU) 2010-05-19 — — EP disclosed
EP-1831239-B1 A PROCESS FOR THE PREPARATION OF 17-HYDROXY-6 BETA, 7 BETA, 15 BETA, 16 BETA -BISMETHYLENE-17 ALPHA-PREGN-4-ENE-3-ONE-21-CARBOXYLIC ACID LAMBDA-LACTONE AND KEY-INTERMEDIATES FOR THIS PROCESS RICHTER GEDEON NYRT (HU) 2010-03-24 — — EP disclosed
WO-1993013122-A1 3-METHYLSULPHONYLHYDRAZONO AND 3-OXYIMINO STEROIDS, A METHOD OF PREPARING THEM, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR USE IN THE PREPARATION OF DRUGS SCHERING AKTIENGESELLSCHAFT (DE) 1993-07-08 — — WO disclosed
EP-0538312-A1 Anti-androgenic [3,2-d]triazole steroids SCHERING AKTIENGESELLSCHAFT (DE) 1993-04-28 — — EP disclosed
WO-1992000992-A1 ANTI-ANDROGENIC [3,2-c]PYRAZOLE AND [3,2-d]TRIAZOLE STEROIDS SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1992-01-23 — — WO disclosed
EP-0150782-B1 PROCESS FOR THE PREPARATION OF 15 ALPHA-HYDROXY ANDROST-4-ENE-3,17-DIONE SCHERING AKTIENGESELLSCHAFT (DE) 1990-07-04 — — EP disclosed
EP-0150782-A2 Process for the preparation of 15 alpha-hydroxy androst-4-ene-3,17-dione SCHERING AKTIENGESELLSCHAFT (DE) 1985-08-07 — — EP disclosed
EP-0150782-A2 Process for the preparation of 15 alpha-hydroxy androst-4-ene-3,17-dione SCHERING AKTIENGESELLSCHAFT (DE) 1985-08-07 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080200668-A1 Industrial Process for the Preparation of 17-Hydroxy-6Beta, 7Beta; 15Beta, 16Beta-Bismethylene-3-Oxo-17Alpha-Pregn-4-Ene-21-Carboxylic Acid Y-Lactone and Key Intermediates for this Process HSD17B7, CYP17A1, HSD17B11 SHBG 73/4885LMNA 2502/4885HSD17B10 45/4885
US-20080194812-A1 Process for the Preparation of 17-Hydroxy-6Beta, 7Beta; 15Beta, 16Beta-Bismethylene- 17Alpha-Pregn-4-Ene-3-One-21-Carboxylic Acid Y-Lactone and Key Intermediates for this Process CYP17A1, HSD17B7, HSD17B11 SHBG 57/4885LMNA 1403/4885HSD17B10 52/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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