SCHEMBL31746900

SCHEMBL31746900

O=C(Cn1ccc2cccc(Nc3ccc4cn[nH]c4c3)c2c1=O)NCC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 14/20 0.42
CLK2 P49760 4/20 0.38
DAPK3 O43293 3/20 0.38
PAK4 O96013 3/20 0.38
PIM1 P11309 3/20 0.38
SYK P43405 3/20 0.38
CSNK1A1 P48729 3/20 0.38
MAP4K2 Q12851 3/20 0.38
DYRK1A Q13627 3/20 0.38
PKN2 Q16513 3/20 0.38
CLK4 Q9HAZ1 3/20 0.38
STK17A Q9UEE5 3/20 0.38
PRKD3 O94806 2/20 0.38
MAP4K4 O95819 2/20 0.38
PRKACA P17612 2/20 0.38
CDK2 P24941 2/20 0.38
FLT3 P36888 2/20 0.38
CDK9 P50750 2/20 0.38
JAK3 P52333 2/20 0.38
CDK5 Q00535 2/20 0.38

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
SCHEMBL25073910 1.00 DDR1 (0.42) DDR1CLK2DAPK3PAK4PIM1
SCHEMBL25073840 0.93 DDR1 (0.44) DDR1ROCK1DDR2ROCK2
SCHEMBL30279189 0.93 DDR1 (0.44) DDR1ROCK1DDR2ROCK2
SCHEMBL25073913 0.88 DDR1 (0.38) DDR1DDR2
SCHEMBL25073903 0.87 DDR1 (0.44) DDR1DDR2
SCHEMBL31746911 0.87 DDR1 (0.44) DDR1DDR2
SCHEMBL25073911 0.87 DDR1 (0.43) DDR1DDR2
SCHEMBL31746927 0.87 DDR1 (0.39) DDR1MAPK1HPGD
SCHEMBL25073790 0.87 DDR1 (0.39) DDR1MAPK1HPGD
SCHEMBL25073865 0.85 DDR1 (0.38) DDR1MAPK1

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
EP-4387963-B1 PHENYL- AND PYRIDOPYRAZOLE DERIVATIVES AS INHIBITORS OF DDR1 REDX PHARMA LTD (GB) 2025-12-24 EP disclosed