SCHEMBL8410289

SCHEMBL8410289

COc1ccc([C@H]2C[C@@]3(C)[C@@H](CCC34OCCO4)[C@@H]3C[C@@H]4O[C@@]45CC4(CC[C@@H]5[C@H]32)OCCO4)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 2/20 0.32
▸ NR3C1 P04150 1/20 0.32
▸ AR P10275 1/20 0.32
▸ KDM1A O60341 1/20 0.30
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 1/20 0.30

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
SCHEMBL8653384 0.84 MAPT (0.38) PGRNR3C1AR
SCHEMBL8407453 0.83 PGR (0.34) PGRNR3C1AR
SCHEMBL8768970 0.81 PGR (0.33) PGRNR3C1AR
SCHEMBL8407252 0.75 PGR (0.37) PGRNR3C1AR
SCHEMBL8410183 0.75 PGR (0.32) PGR
SCHEMBL8948757 0.74 MAPT (0.34) —
SCHEMBL8407415 0.72 — —
SCHEMBL19042635 0.71 NR3C1 (0.38) PGRNR3C1AR
SCHEMBL8410110 0.67 PGR (0.36) PGRNR3C1AR
SCHEMBL5891966 0.67 PGR (0.36) PGRNR3C1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0565553-B1 6,7-MODIFIED 11$g(b)-ARYL-4-ESTRENES SCHERING AG (DE) 1999-07-21 — — EP disclosed
US-5843931-A 6,7-modified 11β-aryl-4-oestrenes SHERING AKTIENGESELLSCHAFT (DE) 1998-12-01 — — US disclosed
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