SCHEMBL4443903

SCHEMBL4443903

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@H]2CC[C@@]2(C)[C@H]1CCC2(O)C(=O)O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.83
▸ SHBG P04278 6/20 0.83
▸ SMN1; SMN2 Q16637 5/20 0.83
▸ SERPINA6 P08185 5/20 0.83
▸ BLM P54132 4/20 0.83
▸ CYP2C19 P33261 3/20 0.83
▸ NR3C1 P04150 3/20 0.83
▸ MEN1 O00255 2/20 0.83
▸ KMT2A Q03164 2/20 0.83
▸ MAPT P10636 2/20 0.83
▸ ADORA3 P0DMS8 1/20 0.83
▸ MAPK3 P27361 1/20 0.83
▸ SLC6A3 Q01959 1/20 0.83
▸ HSD17B10 Q99714 5/20 0.78
▸ TSHR P16473 3/20 0.78
▸ HIF1A Q16665 3/20 0.78
▸ PMP22 Q01453 3/20 0.78
▸ CYP3A4 P08684 1/20 0.78
▸ ALDH1A1 P00352 3/20 0.74
▸ PGR P06401 2/20 0.74

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
SCHEMBL3362526 1.00 LMNA (0.83) LMNASHBGSMN1; SMN2SERPINA6BLM
SCHEMBL11264395 0.92 LMNA (0.81) LMNASHBGSMN1; SMN2SERPINA6BLM
SCHEMBL11264397 0.92 LMNA (0.81) LMNASHBGSMN1; SMN2SERPINA6BLM
Hydroxyprogesterone SCHEMBL13558389 0.91 LMNA (1.00) LMNASHBGSMN1; SMN2SERPINA6BLM
Hydroxyprogesterone SCHEMBL18261234 0.91 LMNA (1.00) LMNASHBGSMN1; SMN2SERPINA6BLM
Hydroxyprogesterone SCHEMBL24287585 0.91 LMNA (1.00) LMNASHBGSMN1; SMN2SERPINA6BLM
Hydroxyprogesterone SCHEMBL14546356 0.91 LMNA (1.00) LMNASHBGSMN1; SMN2SERPINA6BLM
Hydroxyprogesterone SCHEMBL14523053 0.91 LMNA (1.00) LMNASHBGSMN1; SMN2SERPINA6BLM
Hydroxyprogesterone SCHEMBL23456341 0.91 LMNA (1.00) LMNASHBGSMN1; SMN2SERPINA6BLM
Hydroxyprogesterone SCHEMBL265609 0.91 LMNA (1.00) LMNASHBGSMN1; SMN2SERPINA6BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238545-B1 C20 THROUGH C26 AMINO STEROIDS UPJOHN CO (US) 1995-11-15 — — EP claimed
EP-0263213-B1 C20 Through C26 amino steroids UPJOHN CO (US) 1995-09-06 — — EP claimed
WO-2013133980-A1 NITROXY DERIVATIVES OF SOFT STEROIDS BAUSCH & LOMB INCORPORATED (US) 2013-09-12 — — WO disclosed
EP-2026818-A2 COMBINATION OF ANTI-INFLAMMATORY STEROIDS HAVING TRANSPORTER-ENHANCED CORTICOSTEROID ACTIVITY Bodor, Nicholas S. (US) 2009-02-25 — — EP disclosed
WO-2007142842-A2 COMBINATION OF ANTI-INFLAMMATORY STEROIDS HAVING TRANSPORTER-ENHANCED CORTICOSTEROID ACTIVITY BODOR NICHOLAS S (US) 2007-12-13 — — WO disclosed
EP-1658083-B1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SELECTED ANTI-INFLAMMATORY STEROIDS BODOR NICHOLAS S (US) 2007-08-08 — — EP disclosed
EP-1653974-A1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SOFT ANTI-INFLAMMATORY STEROIDS FOR TOPICAL OR OTHER LOCAL APPLICATION BODOR, Nicholas S. (US) 2006-05-10 — — EP disclosed
WO-2005000317-A1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SOFT ANTI-INFLAMMATORY STEROIDS FOR TOPICAL OR OTHER LOCAL APPLICATION BODOR NICHOLAS S (US) 2005-01-06 — — WO disclosed
US-20040082556-A1 Inhibitors of type 5 and type 3 17beta-hydroxysteroid dehydrogenase and methods for their use ENDORECHERCHE, INC. 2004-04-29 — — US disclosed
US-6541463-B1 17-spirolactone derivatives of steroids ENDORECHERCHE, INC. (CA) 2003-04-01 — — US disclosed
EP-1094798-A2 INHIBITORS OF TYPE 5 AND TYPE 3 17beta-HYDROXYSTEROID DEHYDROGENASE AND METHODS FOR THEIR USE Endorecherche Inc. (CA) 2001-05-02 — — EP disclosed
US-5268477-A Containing a pyrrolidine or pyridine ring structure THE UPJOHN COMPANY (US) 1993-12-07 — — US disclosed
US-5175281-A Antiulcer, antiinflammatory, antiischemic, antiallergen, antisecretory, wound healing agents; cardiovascular disorders THE UPJOHN COMPANY (US) 1992-12-29 — — US disclosed
US-5099019-A Central nervous system steroid derivative drugs UPJOHN COMPANY (US) 1992-03-24 — — US disclosed
WO-1990005528-A2 ANTI-THROMBOTIC STEROIDS CHILDREN'S MEDICAL CENTER CORPORATION (US) 1990-05-31 — — WO disclosed
EP-0263213-A1 C20 Through C26 amino steroids THE UPJOHN COMPANY (US) 1988-04-13 — — EP disclosed
EP-0238545-A1 C 20? THROUGH C 26? AMINO STEROIDS. UPJOHN CO (US) 1987-09-30 — — EP disclosed
WO-1987001706-A2 C20 THROUGH C26 AMINO STEROIDS THE UPJOHN COMPANY (US) 1987-03-26 — — WO disclosed
US-4348327-A Process for the preparation of 17α-hydroxy- and 17aα-hydroxy-D-homoetiocarboxylic acids SCHERING AKTIENGESELLSCHAFT (DE) 1982-09-07 — — US disclosed
US-4252729-A Steroids and process for their manufacture HOFFMANN-LA ROCHE INC. (US) 1981-02-24 — — 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 (1 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-20040082556-A1 Inhibitors of type 5 and type 3 17beta-hydroxysteroid dehydrogenase and methods for their use HSD17B11, HSD17B3, HSD17B1 LMNA 3211/4885SHBG 33/4885SMN1; SMN2 3214/4885

“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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