SCHEMBL1671020

SCHEMBL1671020

Cc1cc(O)ccc1-c1c(Br)c(C)c(/C=N/O)n1-c1c(C)noc1C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.34
ESR2 Q92731 5/20 0.34
HSP90AB1 P08238 1/20 0.32

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
SCHEMBL1671021 1.00 ESR1 (0.34) ESR1ESR2HSP90AB1
SCHEMBL1670320 0.90 ESR1 (0.34) ESR1ESR2HSP90AB1
SCHEMBL1670615 0.90 ESR1 (0.34) ESR1ESR2HSP90AB1
SCHEMBL1672953 0.82 ESR2 (0.36) ESR1ESR2HSP90AB1
SCHEMBL1672952 0.82 ESR2 (0.36) ESR1ESR2HSP90AB1
SCHEMBL1670917 0.78 TTR (0.38) ESR1ESR2HSP90AB1
SCHEMBL12801005 0.78 TTR (0.34) ESR1ESR2HSP90AB1
SCHEMBL1670649 0.75 ESR1 (0.35) ESR1ESR2HSP90AB1
SCHEMBL1670945 0.73 BRD4 (0.34)
SCHEMBL1670948 0.73 BRD4 (0.34)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011042477-A1 SUBSTITUTED PYRROLES AND IMIDAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 WO claimed