SCHEMBL14013199

SCHEMBL14013199

C=Cc1cc(O)cc2ncn(-c3ccc(O)cc3)c(=O)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 20/20 1.00
ESR1 P03372 13/20 0.71

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
SCHEMBL5128716 0.83 ESR2 (1.00) ESR2ESR1
SCHEMBL5121607 0.82 ESR2 (0.97) ESR2ESR1
SCHEMBL5121612 0.82 ESR2 (0.97) ESR2ESR1
SCHEMBL14013175 0.81 ESR2 (1.00) ESR2ESR1
SCHEMBL14013204 0.81 ESR2 (1.00) ESR2ESR1
SCHEMBL14013196 0.79 ESR2 (1.00) ESR2ESR1
SCHEMBL14013182 0.78 ESR2 (1.00) ESR2ESR1
SCHEMBL14013195 0.78 ESR2 (1.00) ESR2ESR1
SCHEMBL5121192 0.77 ESR2 (1.00) ESR2ESR1
SCHEMBL14013201 0.77 ESR2 (1.00) ESR2ESR1

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-7456188-B1 C-5 substituted quinazolinone derivatives as selective estrogen receptor beta modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
US-7456188-B1 C-5 substituted quinazolinone derivatives as selective estrogen receptor beta modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed