SCHEMBL1650324

SCHEMBL1650324

C[C@]12CCCCC1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 7/20 1.00
HSD17B3 P37058 5/20 0.69
AKR1B10 O60218 2/20 0.68
AKR1B1 P15121 2/20 0.68
OR51E2 Q9H255 1/20 0.68
GPBAR1 Q8TDU6 4/20 0.65
LMNA P02545 3/20 0.65
CYP3A4 P08684 3/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
SHBG P04278 2/20 0.65
SERPINA6 P08185 2/20 0.65
MAPK1 P28482 1/20 0.65
PMP22 Q01453 1/20 0.65
G6PD P11413 1/20 0.65
CYP2D6 P10635 1/20 0.65
TSHR P16473 1/20 0.65
NFKB1 P19838 1/20 0.65
CYP2C19 P33261 1/20 0.65

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
SCHEMBL5925374 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL12825203 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL1552239 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL17817126 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL1908291 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL10273218 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL12370187 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL17341027 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL20714758 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2
SCHEMBL12178030 1.00 CYP19A1 (1.00) CYP19A1HSD17B3AKR1B10AKR1B1OR51E2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109956989-B Recycling method of position isomer in preparation of 3 beta-acetoxyl-5 alpha-chlorine-6 beta-hydroxyandrost-17-one 华东师范大学 2021-11-19 CN claimed
US-20160272670-A1 STEROIDS HAVING INCREASED WATER SOLUBILITY AND RESISTANCE AGAINST METABOLISM AND METHODS FOR THEIR PRODUCTION UMECRINE AB (SE) 2016-09-22 US claimed
US-20130102578-A1 New Steroids Having Increased Water Solubility and Resistance Against Metabolism and Methods For Their Production UMECRINE AB (SE) 2013-04-25 US claimed
EP-2097437-A1 THE USE OF PREGNANE AND ANDROSTANE STEROIDS FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CNS DISORDERS Umecrine AB (SE) 2009-09-09 EP claimed
WO-2009012955-A2 PROCESS FOR THE PREPARATION OF DROSPIRENONE NEWCHEM S.P.A. (IT) 2009-01-29 WO claimed
WO-2008063128-A1 THE USE OF PREGNANE AND ANDROSTANE STEROIDS FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CNS DISORDERS UMECRINE AB (SE) 2008-05-29 WO claimed
US-20080119416-A1 NEW STEROIDS HAVING INCREASED WATER SOLUBILITY AND RESISTANCE AGAINST METABOLISM, AND METHODS FOR THEIR PRODUCTION UMECRINE AB (SE) 2008-05-22 US claimed
EP-1351971-A2 COMPOUNDS USEFUL FOR TREATING HYPERTRIGLYCERIDEMIA Aeson Therapeutics Inc. (US) 2003-10-15 EP claimed
WO-2002028880-A2 COMPOUNDS USEFUL FOR TREATING HYPERTRIGLYCERIDEMIA AESON THERAPEUTICS INC. (US) 2002-04-11 WO claimed
EP-1163256-A1 HEMIHYDRATE OF 16.ALPHA.-BROMOEPIANDROSTERONE Hollis-Eden Pharmaceuticals Inc. (US) 2001-12-19 EP claimed
WO-2000056757-A1 IMMUNOMODULATORY STEROIDS, IN PARTICULAR THE HEMIHYDRATE OF 16.ALPHA.-BROMOEPIANDROSTERONE HOLLIS-EDEN PHARMACEUTICALS, INC. (US) 2000-09-28 WO claimed
US-3968132-A (17R)-Spiro-[androstane-17,1'-cyclobutan]-2'-ones, methods for their manufacture and intermediates useful therein SCHERING CORPORATION (US) 1976-07-06 US claimed
US-12577526-B2 Massively parallel on-chip construction of synthetic microbial communities THE BROAD INSTITUTE, INC. (US) 2026-03-17 US disclosed
US-20250376656-A1 MASSIVELY PARALLEL ON-CHIP CONSTRUCTION OF SYNTHETIC MICROBIAL COMMUNITIES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2025-12-11 US disclosed
CN-111971292-B Glass formulations comprising steroid dimers and uses thereof 波纹疗法公司 2024-12-13 CN disclosed
US-20240383941-A1 3-ALPHA SUBSTITUTED 3-BETA-HYDROXY-17-OXIMATED ANDROSTANE COMPOUND FOR MODULATION OF THE ALPHA-3 SUBTYPE OF THE GABAA RECEPTOR UMECRINE AB (SE) 2024-11-21 US disclosed
US-3985771-A Total steroid synthesis employing substituted isoxazole derivatives HOFFMANN-LA ROCHE INC. (US) 1976-10-12 US disclosed
US-3984428-A Isoxazolyl-substituted perhydrobenzindenes HOFFMANN-LA ROCHE INC. (US) 1976-10-05 US disclosed
US-3968132-A (17R)-Spiro-[androstane-17,1'-cyclobutan]-2'-ones, methods for their manufacture and intermediates useful therein SCHERING CORPORATION (US) 1976-07-06 US disclosed
US-3968132-A (17R)-Spiro-[androstane-17,1'-cyclobutan]-2'-ones, methods for their manufacture and intermediates useful therein SCHERING CORPORATION (US) 1976-07-06 US 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 (5 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-20240383941-A1 3-ALPHA SUBSTITUTED 3-BETA-HYDROXY-17-OXIMATED ANDROSTANE COMPOUND FOR MODULATION OF THE ALPHA-3 SUBTYPE OF THE GABAA RECEPTOR HSD3B1, HSD17B3, HSD3B2 CYP19A1 20/4885HSD17B3 2/4885AKR1B10 319/4885
US-20130102578-A1 New Steroids Having Increased Water Solubility and Resistance Against Metabolism and Methods For Their Production CYP11B1, CYP11A1, CYP11B2 CYP19A1 35/4885HSD17B3 14/4885AKR1B10 170/4885
US-20160272670-A1 STEROIDS HAVING INCREASED WATER SOLUBILITY AND RESISTANCE AGAINST METABOLISM AND METHODS FOR THEIR PRODUCTION CYP11B1, CYP11A1, CYP11B2 CYP19A1 35/4885HSD17B3 15/4885AKR1B10 197/4885
US-20080119416-A1 NEW STEROIDS HAVING INCREASED WATER SOLUBILITY AND RESISTANCE AGAINST METABOLISM, AND METHODS FOR THEIR PRODUCTION CYP21A2, CYP11B1, CYP11A1 CYP19A1 32/4885HSD17B3 14/4885AKR1B10 161/4885
US-12577526-B2 Massively parallel on-chip construction of synthetic microbial communities STUB1, SAMM50, CD14 CYP19A1 2989/4885HSD17B3 2385/4885AKR1B10 3045/4885

“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.