SCHEMBL24399715

SCHEMBL24399715

CC#CCc1cccc(Cc2nccc3c(NC(=O)c4cccc5c(N)ncnc45)c(C)ccc23)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 14/20 0.47
RAF1 P04049 10/20 0.47
CSF1R P07333 5/20 0.47
DDR1 Q08345 5/20 0.47
DDR2 Q16832 5/20 0.47
ARAF P10398 1/20 0.44
ERN1 O75460 2/20 0.38
AURKA O14965 3/20 0.35
RPS6KB1 P23443 3/20 0.35
AURKB Q96GD4 1/20 0.33

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
SCHEMBL25375666 0.88 BRAF (0.50) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL29638693 0.88 BRAF (0.50) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399550 0.79 BRAF (0.63) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399664 0.75 BRAF (0.65) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL29638547 0.75 BRAF (0.65) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL30400396 0.75 BRAF (0.52) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL25372913 0.75 BRAF (0.52) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL29638522 0.75 BRAF (0.78) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399554 0.75 BRAF (0.78) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399744 0.74 BRAF (0.72) BRAFRAF1CSF1RDDR1DDR2

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