SCHEMBL8501285

SCHEMBL8501285

C=CC(C(=O)O)c1ccc(Oc2c(-c3ccc(O)cc3)ccc3cc(O)ccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 20/20 0.48
ESR2 Q92731 15/20 0.48

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
SCHEMBL8497567 0.95 ESR1 (0.43) ESR1ESR2
SCHEMBL8497265 0.94 ESR1 (0.52) ESR1ESR2
SCHEMBL8498119 0.94 ESR1 (0.43) ESR1ESR2
SCHEMBL8501398 0.91 ESR1 (0.51) ESR1ESR2
SCHEMBL8500430 0.89 PPARG (0.39) ESR1ESR2
SCHEMBL8501044 0.86 AKR1C3 (0.43) ESR1ESR2
SCHEMBL8499781 0.84 ESR1 (0.51) ESR1ESR2
SCHEMBL8500328 0.83 AKR1C3 (0.42) ESR1ESR2
SCHEMBL8501228 0.83 AKR1C3 (0.44) ESR1ESR2
SCHEMBL8499334 0.81 ESR1 (0.51) ESR1ESR2

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
US-5916916-A USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. ELI LILLY AND COMPANY (US) 1999-06-29 US claimed
US-5916916-A USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. ELI LILLY AND COMPANY (US) 1999-06-29 US disclosed