SCHEMBL29638490

SCHEMBL29638490

Cc1ccc2c(Nc3cc(F)c(F)c(F)c3F)nccc2c1N1CN=C(N)c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.31
RAF1 P04049 1/20 0.31
CSF1R P07333 1/20 0.31
ARAF P10398 1/20 0.31
BRAF P15056 1/20 0.31
DDR1 Q08345 1/20 0.31
DDR2 Q16832 1/20 0.31

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
SCHEMBL29638645 0.90 BRAF (0.33) MAPK14RAF1CSF1RARAFBRAF
SCHEMBL29638669 0.83 TNNI3K (0.35) MAPK14
SCHEMBL29638518 0.80 FGFR1 (0.36) MAPK14RAF1BRAF
SCHEMBL29638749 0.79 BRAF (0.38) BRAF
SCHEMBL29638578 0.77 RAF1 (0.43) RAF1CSF1RARAFBRAFDDR1
SCHEMBL29638623 0.77 KDM1A (0.38) RAF1CSF1RBRAF
SCHEMBL29638666 0.77 MAPK1 (0.36) RAF1CSF1RBRAFDDR1DDR2
SCHEMBL29638508 0.76 BRAF (0.35) RAF1BRAF
SCHEMBL29638582 0.76 BRAF (0.35) RAF1CSF1RARAFBRAFDDR1
SCHEMBL26210990 0.76 BRAF (0.35) RAF1CSF1RARAFBRAFDDR1

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-2022089219-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2022-05-05 WO disclosed