SCHEMBL16655518

SCHEMBL16655518

NC(c1cc(Cl)cc(Cl)c1)c1ccnc(Cl)n1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
MAPK9 P45984 1/20 0.33
MAPK10 P53779 1/20 0.33
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
CCR1 P32246 1/20 0.30
CCR5 P51681 1/20 0.30
CCR8 P51685 1/20 0.30
ROCK1 Q13464 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
SCHEMBL14488519 0.78 TRPV1 (0.33) MAPK9MAPK10IDO1TDO2
SCHEMBL4295168 0.74 ROCK1 (0.40) ROCK1
SCHEMBL28404695 0.72 MAPK9 (0.37) POLBMAPK9MAPK10
SCHEMBL3452399 0.70 MAPT (0.39) MAPK9MAPK10IDO1TDO2
SCHEMBL27523149 0.70 MAPK9 (0.38) POLBMAPK9MAPK10
SCHEMBL28488709 0.68 MAPK9 (0.35) MAPK9MAPK10
SCHEMBL4256516 0.68 MAPK9 (0.35) POLBMAPK9MAPK10ROCK1
SCHEMBL2014685 0.67 TGFBR1 (0.39) MAPK9MAPK10
SCHEMBL558541 0.67 MAPK9 (0.39) POLBMAPK9MAPK10
SCHEMBL30463164 0.67 MAPK9 (0.34) POLBMAPK9MAPK10

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-2015057963-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed