SCHEMBL2372855

SCHEMBL2372855

Cc1c(-c2cccc(C(F)(F)F)c2)nc2ccccc2c1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 14/20 0.71
PDE10A Q9Y233 4/20 0.69
TSHR P16473 1/20 0.69
KMT2A Q03164 1/20 0.53
PTGFR P43088 1/20 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
SCHEMBL2373344 0.90 DHODH (0.82) DHODHPDE10ATSHRPTGFR
SCHEMBL2373011 0.89 DHODH (0.58) DHODHPDE10ATSHRKMT2APTGFR
SCHEMBL2373037 0.88 DHODH (0.70) DHODHPDE10ATSHRKMT2A
SCHEMBL2371929 0.88 DHODH (0.61) DHODHPDE10ATSHRKMT2APTGFR
SCHEMBL2372739 0.87 DHODH (0.71) DHODHPDE10A
SCHEMBL2373103 0.87 DHODH (0.70) DHODHKMT2APTGFR
SCHEMBL2372504 0.86 DHODH (0.69) DHODHPDE10ATSHRPTGFR
SCHEMBL2373290 0.86 DHODH (0.59) DHODHPDE10ATSHRPTGFR
SCHEMBL2373480 0.86 DHODH (0.60) DHODHPDE10ATSHRPTGFR
SCHEMBL17594324 0.85 DHODH (0.95) DHODHPDE10ATSHRPTGFR

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-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed