SCHEMBL7458636

SCHEMBL7458636

CCC(=C(c1ccc(O)cc1)c1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 16/20 0.83
▸ ESR2 Q92731 10/20 0.83
▸ CYP19A1 P11511 8/20 0.83
▸ PTGS2 P35354 1/20 0.64
▸ PGR P06401 1/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2A6 P11509 1/20 0.59
▸ CYP3A5 P20815 1/20 0.59

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
SCHEMBL29998343 1.00 ESR1 (0.83) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL23851086 0.91 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL5354173 0.91 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL5818558 0.91 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL639225 0.91 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL5354177 0.91 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
SCHEMBL7723356 0.91 ESR1 (1.00) ESR1ESR2CYP19A1PTGS2PGR
Phenol SCHEMBL7723405 0.90 ESR1 (0.96) ESR1ESR2CYP19A1PTGS2PGR
Phenol SCHEMBL10796309 0.90 ESR1 (0.96) ESR1ESR2CYP19A1PTGS2PGR
Phenol SCHEMBL10796314 0.90 ESR1 (0.96) ESR1ESR2CYP19A1PTGS2PGR

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-1235776-A1 TRIPHENYLALKENE DERIVATIVES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS Hormos Medical Corporation (FI) 2002-09-04 — — EP disclosed
WO-2001036360-A1 TRIPHENYLALKENE DERIVATIVES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS HORMOS MEDICAL CORPORATION (FI) 2001-05-25 — — WO disclosed
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