SCHEMBL8768957

SCHEMBL8768957

C[C@]1(O)CC=C2[C@@H]3CC=C4CC5(CC[C@@H]4[C@H]3[C@@H](c3ccc(O)cc3)C[C@@]21C)OCCO5

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 2/20 0.31
▸ ESR1 P03372 1/20 0.31

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
SCHEMBL8767953 0.92 PARP1 (0.31) —
SCHEMBL8768005 0.88 — —
SCHEMBL8768206 0.87 — —
SCHEMBL8768846 0.86 — —
SCHEMBL8768906 0.85 — —
SCHEMBL8653911 0.74 MAPT (0.48) ESR2ESR1
SCHEMBL8767744 0.74 PGR (0.32) —
SCHEMBL8410110 0.73 PGR (0.36) —
SCHEMBL5891966 0.73 PGR (0.36) —
SCHEMBL8768994 0.71 HSD17B1 (0.33) —

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-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
Send feedback