SCHEMBL8767815

SCHEMBL8767815

C#C[C@]1(O)C=C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3[C@@H](c3ccc(C(C)=O)cc3)C[C@@]21C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 12/20 0.49
▸ AR P10275 9/20 0.49
▸ LMNA P02545 3/20 0.49
▸ ESR1 P03372 2/20 0.49
▸ SLC6A4 P31645 2/20 0.49
▸ OPRM1 P35372 1/20 0.49
▸ NR3C1 P04150 10/20 0.45
▸ CYP3A4 P08684 5/20 0.43
▸ ABCB11 O95342 3/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ SHBG P04278 1/20 0.42
▸ ADRA2A P08913 1/20 0.42
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40

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
SCHEMBL8767965 0.91 NR3C1 (0.46) PGRARLMNAESR1SLC6A4
SCHEMBL8767961 0.88 PGR (0.48) PGRARLMNAESR1SLC6A4
SCHEMBL8767722 0.88 PGR (0.48) PGRARLMNAESR1SLC6A4
SCHEMBL8768220 0.86 PGR (0.47) PGRARLMNAESR1SLC6A4
SCHEMBL8768225 0.86 PGR (0.47) PGRARLMNAESR1SLC6A4
SCHEMBL8769022 0.84 PGR (0.47) PGRARLMNAESR1SLC6A4
SCHEMBL5498047 0.83 NR3C1 (0.44) PGRARLMNAESR1SLC6A4
SCHEMBL8768886 0.80 NR3C1 (0.49) PGRARLMNAESR1SLC6A4
SCHEMBL8650867 0.77 PGR (0.49) PGRARLMNAESR1SLC6A4
SCHEMBL8767749 0.77 NR3C1 (0.49) PGRARLMNAESR1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0567469-B1 14beta-H-, 14- AND 15-EN-11beta-ARYL-4-ESTRENES SCHERING AG (DE) 1997-08-27 — — EP claimed
EP-0567469-B1 14beta-H-, 14- AND 15-EN-11beta-ARYL-4-ESTRENES SCHERING AG (DE) 1997-08-27 — — EP disclosed
US-5426102-A Antigestagenic, antiandrogenic, antiglucocorticoid, antimineralcorticoid properties SCHERING AKTIENGESELLSCHAFT (DE) 1995-06-20 — — US disclosed
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