SCHEMBL1672207

SCHEMBL1672207

Cc1oc(F)c(C)c1-c1c(-c2ccc(O)cc2)c(Br)n(C)c1C#N

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.38
SENP1 Q9P0U3 1/20 0.35
MAPK13 O15264 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32
MAPK14 Q16539 1/20 0.32
GRIA4 P48058 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
SCHEMBL1670563 0.83 GRIA4 (0.39) ARSENP1MAPK13CYP2C9CYP2C19
SCHEMBL12801021 0.82 SENP1 (0.34) SENP1
SCHEMBL1670503 0.79 AR (0.39) ARSENP1GRIA4
SCHEMBL1670817 0.78 MLYCD (0.40) AR
SCHEMBL1672959 0.77 SENP1 (0.31) SENP1
SCHEMBL1672956 0.76 SENP1 (0.30) SENP1
SCHEMBL1672957 0.76 SENP1 (0.30) SENP1
SCHEMBL1670860 0.72 AR (0.46) ARSENP1MAPK13CYP2C9CYP2C19
SCHEMBL1670318 0.68 SENP1 (0.30) SENP1
SCHEMBL1670319 0.65 SENP1 (0.30) SENP1

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 disclosed