SCHEMBL1670805

SCHEMBL1670805

Cc1noc(C)c1-c1c(/C(N)=N/O)c(C)c(Cl)n1-c1ccc(O)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.34
CREBBP Q92793 2/20 0.31
AR P10275 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
BRD2 P25440 1/20 0.30
TSHR P16473 1/20 0.30
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
FTO Q9C0B1 1/20 0.30

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
SCHEMBL1670809 1.00 BRD4 (0.34) BRD4CREBBPARESR1ESR2
SCHEMBL1672972 0.87 TSHR (0.41) BRD4CREBBPARBRD2TSHR
SCHEMBL1667583 0.82 BRD4 (0.33) BRD4ESR1ESR2
SCHEMBL1667584 0.82 BRD4 (0.33) BRD4ESR1ESR2
SCHEMBL12800297 0.82 BRD4 (0.38) BRD4CREBBPARESR1ESR2
SCHEMBL1671029 0.81
SCHEMBL1671031 0.81
SCHEMBL2312965 0.81 ERN1 (0.34) BRD4
SCHEMBL2307797 0.81 ERN1 (0.34) BRD4
SCHEMBL1077417 0.81 ESR1 (0.38) BRD4CREBBPESR1ESR2BRD2

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