SCHEMBL8540843

SCHEMBL8540843

CCc1ccc([C@H]2C[C@@]3(C)[C@@H](CC[C@@]3(O)/C=C\CO)[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]32)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 10/20 0.53
▸ NR3C1 P04150 10/20 0.53
▸ AR P10275 7/20 0.53
▸ CYP3A4 P08684 4/20 0.49
▸ LMNA P02545 3/20 0.41
▸ ABCB11 O95342 2/20 0.41
▸ SHBG P04278 2/20 0.41
▸ SLC6A4 P31645 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ POLB P06746 1/20 0.37

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
SCHEMBL8541351 0.92 PGR (0.53) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8538261 0.92 PGR (0.53) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8541353 0.92 PGR (0.53) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8539739 0.89 PGR (0.53) PGRNR3C1ARCYP3A4LMNA
SCHEMBL4665348 0.89 PGR (0.65) PGRNR3C1ARCYP3A4
SCHEMBL8536196 0.89 PGR (0.53) PGRNR3C1ARCYP3A4LMNA
SCHEMBL7148540 0.89 PGR (0.65) PGRNR3C1ARCYP3A4
SCHEMBL6453812 0.89 PGR (0.65) PGRNR3C1ARCYP3A4
SCHEMBL7148546 0.89 PGR (0.65) PGRNR3C1ARCYP3A4
SCHEMBL8768021 0.89 PGR (0.53) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0404283-B1 11-Beta-aryl-4-estrene, method for its production and its use as a medicine SCHERING AG (DE) 1996-05-08 — — EP claimed
EP-0404283-A2 11-Beta-aryl-4-estrene, method for its production and its use as a medicine SCHERING AKTIENGESELLSCHAFT (DE) 1990-12-27 — — EP claimed
US-5843933-A 11β-aryl-4-estrenes, process for their production as well as their use as pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1998-12-01 — — US disclosed
US-5728689-A ANTIGESTAGENIC EFFECT SCHERING AKTIENGESELLSCHAFT (DE) 1998-03-17 — — US disclosed
EP-0404283-B1 11-Beta-aryl-4-estrene, method for its production and its use as a medicine SCHERING AG (DE) 1996-05-08 — — EP disclosed
EP-0404283-A2 11-Beta-aryl-4-estrene, method for its production and its use as a medicine SCHERING AKTIENGESELLSCHAFT (DE) 1990-12-27 — — EP disclosed
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