SCHEMBL28077209

SCHEMBL28077209

Oc1nc(-c2ccc(F)cc2)sc1O

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.62
APP P05067 4/20 0.51
SULT1A1 P50225 1/20 0.51
TRPM8 Q7Z2W7 2/20 0.51

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
SCHEMBL9629483 0.81 ALOX5 (0.58) ALOX5
SCHEMBL28831015 0.80 ALOX5 (0.62) ALOX5TRPM8
SCHEMBL28315188 0.79 MAPT (0.55) ALOX5
SCHEMBL1954805 0.79 ALOX5 (0.56) ALOX5TRPM8
SCHEMBL28077371 0.78 TRPM8 (0.64) TRPM8
SCHEMBL15049252 0.77 CDC7 (0.67) ALOX5TRPM8
SCHEMBL9628733 0.77 ALOX5 (1.00) ALOX5TRPM8
SCHEMBL13801077 0.74 ALOX5 (0.50) ALOX5APPSULT1A1TRPM8
SCHEMBL17374845 0.72 TRPM8 (0.71) ALOX5TRPM8
SCHEMBL28077336 0.72 HDAC9 (0.39) ALOX5TRPM8

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
CN-104334544-B Benzimidazole proline derivative 埃科特莱茵药品有限公司 2016-10-19 CN disclosed