SCHEMBL1670945

SCHEMBL1670945

Cc1cc(-c2ccc(O)cc2)n(-c2c(C)noc2C)c1/C=N/O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.34
ERN1 O75460 1/20 0.33
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
TTR P02766 1/20 0.31

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
SCHEMBL1670948 1.00 BRD4 (0.34) BRD4ERN1GAAMAPK1TTR
SCHEMBL1672952 0.86 ESR2 (0.36) GAAMAPK1
SCHEMBL1672953 0.86 ESR2 (0.36) GAAMAPK1
SCHEMBL1671187 0.86 ERN1 (0.34) ERN1TTR
SCHEMBL1671189 0.86 ERN1 (0.34) ERN1TTR
SCHEMBL1670649 0.84 ESR1 (0.35) TTR
SCHEMBL1671281 0.81 BRD4 (0.33) BRD4ERN1
SCHEMBL1671278 0.81 BRD4 (0.33) BRD4ERN1
SCHEMBL1670273 0.78 BRD4 (0.33) BRD4ERN1TTR
SCHEMBL1670272 0.78 BRD4 (0.33) BRD4ERN1TTR

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