SCHEMBL9348234

SCHEMBL9348234

C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)O

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SERPINA6 P08185 4/20 0.85
▸ FNTA P49354 1/20 0.69
▸ FNTB P49356 1/20 0.69
▸ SMN1; SMN2 Q16637 7/20 0.61
▸ LMNA P02545 6/20 0.61
▸ POLB P06746 1/20 0.61
▸ CYP3A4 P08684 6/20 0.61
▸ ALDH1A1 P00352 6/20 0.61
▸ MAPT P10636 4/20 0.61
▸ MAPK1 P28482 4/20 0.61
▸ TSHR P16473 3/20 0.61
▸ SHBG P04278 3/20 0.61
▸ CYP2C9 P11712 2/20 0.61
▸ HIF1A Q16665 2/20 0.61
▸ NR3C2 P08235 2/20 0.61
▸ NR3C1 P04150 2/20 0.61
▸ PMP22 Q01453 2/20 0.61
▸ ABCB11 O95342 2/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ KDM4E B2RXH2 1/20 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
SCHEMBL9348241 1.00 SERPINA6 (0.85) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL18927106 1.00 SERPINA6 (0.85) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL15920543 0.92 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL14420894 0.92 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL668966 0.92 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL15904593 0.92 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL14525642 0.92 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL6347180 0.90 SERPINA6 (0.84) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL31095098 0.89 SERPINA6 (0.82) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL5497592 0.88 SERPINA6 (0.80) SERPINA6FNTAFNTBSMN1; SMN2LMNA

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0427434-B1 11-keto or hydroxy 3,5-diene steroids as inhibitors of steroid 5-alpha-reductase SMITHKLINE BEECHAM CORP (US) 1994-12-14 — — EP disclosed
EP-0375351-B1 Phosphonic acid substituted steroids as steroid 5alpha-reductase inhibitors SMITHKLINE BEECHAM CORP (US) 1994-08-31 — — EP disclosed
EP-0375349-B1 Phosphinic acid substituted steroids as inhibitors of steroid 5alpha-reductase SMITHKLINE BEECHAM CORP (US) 1994-08-31 — — EP disclosed
EP-0289327-B1 STEROID 5-ALPHA-REDUCTASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1991-12-18 — — EP disclosed
US-5041433-A 11-keto or hydroxy 3,5-diene steroids as inhibitors of steriod 5-α-reductase SMITHKLINE BEECHAM CORPORATION (US) 1991-08-20 — — US disclosed
US-5026882-A Phosphinic acid substituted steroids as inhibitors of steroid 5α-reductase SMITHKLINE BEECHAM CORPORATION (US) 1991-06-25 — — US disclosed
US-5017568-A Enzyme inhibitors, carboxylation SMITHKLINE BEECHAM CORPORATION (US) 1991-05-21 — — US disclosed
EP-0427434-A2 11-keto or hydroxy 3,5-diene steroids as inhibitors of steroid 5-alpha-reductase SMITHKLINE BEECHAM CORPORATION (US) 1991-05-15 — — EP disclosed
US-4946834-A ACRYLATE ANALOGUES OF STEROIDAL SYNTHETIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1990-08-07 — — US disclosed
EP-0375351-A1 Phosphonic acid substituted steroids as steroid 5alpha-reductase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1990-06-27 — — EP disclosed
EP-0375349-A1 Phosphinic acid substituted steroids as inhibitors of steroid 5alpha-reductase SMITHKLINE BEECHAM CORPORATION (US) 1990-06-27 — — EP disclosed
EP-0289327-A2 Steroid 5-alpha-reductase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1988-11-02 — — EP disclosed
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