SCHEMBL8653263

SCHEMBL8653263

CC(=O)c1ccc([C@H]2C[C@@]3(C)[C@@H](CC=C(Cl)C3(O)CCCO)[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]32)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 9/20 0.45
▸ NR3C1 P04150 8/20 0.43
▸ AR P10275 8/20 0.43
▸ CYP3A4 P08684 2/20 0.41
▸ SERPINA6 P08185 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ SLC22A1 O15245 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ SHBG P04278 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL8652053 0.91 PGR (0.45) PGRNR3C1ARCYP3A4SERPINA6
SCHEMBL8652950 0.84 PGR (0.48) PGRNR3C1ARCYP3A4SERPINA6
SCHEMBL8652943 0.84 PGR (0.44) PGRNR3C1ARCYP3A4SERPINA6
SCHEMBL8767831 0.83 PGR (0.53) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8652764 0.82 PGR (0.50) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8652174 0.81 PGR (0.49) PGRNR3C1ARCYP3A4SERPINA6
SCHEMBL8650251 0.78 PGR (0.48) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8653302 0.77 PGR (0.37) PGRNR3C1ARCYP3A4SERPINA6
SCHEMBL8767796 0.75 PGR (0.55) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8768805 0.75 PGR (0.55) PGRNR3C1ARCYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0567472-B1 D-HOMO-(16-EN)-11 BETA-ARYL-4-ESTRENES, PROCESS FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS SCHERING AG (DE) 1998-10-07 — — EP claimed
US-5519027-A PROGESTERONE ANTAGONIST FOR OXYTOCICS OR PREVENTION OF TERMINATION OF PREGNANCY SCHERING AKTIENGESELLSCHAFT (DE) 1996-05-21 — — US claimed
EP-0567472-B1 D-HOMO-(16-EN)-11 BETA-ARYL-4-ESTRENES, PROCESS FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS SCHERING AG (DE) 1998-10-07 — — EP disclosed
US-5519027-A PROGESTERONE ANTAGONIST FOR OXYTOCICS OR PREVENTION OF TERMINATION OF PREGNANCY SCHERING AKTIENGESELLSCHAFT (DE) 1996-05-21 — — US disclosed
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