SCHEMBL24399585

SCHEMBL24399585

CNc1ncnc2c(C(=O)Nc3c(C)ccc4c(Cc5ccc(Cl)cc5)nccc34)csc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.60
RAF1 P04049 10/20 0.60
CSF1R P07333 5/20 0.60
DDR1 Q08345 5/20 0.60
DDR2 Q16832 5/20 0.60
ARAF P10398 1/20 0.50
GAA P10253 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
PKM P14618 1/20 0.36
ERN1 O75460 2/20 0.35
LPAR1 Q92633 1/20 0.34
LPAR2 Q9HBW0 1/20 0.34
CYP2C9 P11712 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PIK3CA P42336 1/20 0.33
LCK P06239 1/20 0.33
KDR P35968 1/20 0.33
TEK Q02763 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
SCHEMBL24399666 0.90 BRAF (0.72) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL29638637 0.90 BRAF (0.72) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL21127378 0.85 BRAF (0.81) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL30402026 0.84 RAF1 (0.49) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399586 0.84 RAF1 (0.49) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399667 0.81 BRAF (0.60) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL29638615 0.81 BRAF (0.60) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399669 0.80 BRAF (0.71) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL24399557 0.80 BRAF (0.64) BRAFRAF1CSF1RDDR1DDR2
SCHEMBL29638470 0.80 BRAF (0.71) 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