SCHEMBL8499330

SCHEMBL8499330

CCCC(=O)Oc1ccc(Oc2c(-c3ccc(O)cc3)ccc3cc(O)ccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 18/20 0.53
ESR2 Q92731 17/20 0.53
BCL9 O00512 1/20 0.40
CTNNB1 P35222 1/20 0.40
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL8498096 0.95 ESR1 (0.48) ESR1ESR2RAB9AKMT2A
SCHEMBL8499778 0.92 ESR1 (0.54) ESR1ESR2RAB9AKMT2A
SCHEMBL8502300 0.90 ESR1 (0.56) ESR1ESR2BCL9CTNNB1
SCHEMBL8497550 0.87 ESR1 (0.49) ESR1ESR2RAB9AKMT2A
SCHEMBL8497879 0.86 KMT2A (0.42) ESR1ESR2BCL9CTNNB1RAB9A
SCHEMBL8500225 0.86 ESR1 (0.48) ESR1ESR2KMT2A
SCHEMBL8497867 0.86 ESR1 (0.57) ESR1ESR2
SCHEMBL7182784 0.85 ESR1 (0.46) ESR1ESR2
SCHEMBL8501462 0.84 ESR1 (0.47) ESR1ESR2KMT2A
SCHEMBL8501283 0.84 ESR1 (0.52) 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