SCHEMBL29638616

SCHEMBL29638616

Cc1ccc2c(Cc3ccccc3C(F)(F)F)nccc2c1NC(=O)c1csc2c(N)ncnc12

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 13/20 0.56
CSF1R P07333 12/20 0.56
RAF1 P04049 11/20 0.56
DDR2 Q16832 6/20 0.56
DDR1 Q08345 5/20 0.56
ARAF P10398 1/20 0.56
CYP2C9 P11712 1/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
TEK Q02763 1/20 0.39
MELK Q14680 1/20 0.39

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
SCHEMBL24399584 1.00 BRAF (0.56) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL24399748 0.90 BRAF (0.56) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL29638546 0.90 BRAF (0.56) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL29638747 0.90 BRAF (0.60) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL24399549 0.90 BRAF (0.60) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL24399664 0.88 BRAF (0.65) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL29638547 0.88 BRAF (0.65) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL24399550 0.86 BRAF (0.63) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL25374865 0.86 BRAF (0.58) BRAFCSF1RRAF1DDR2DDR1
SCHEMBL29638524 0.86 BRAF (0.58) BRAFCSF1RRAF1DDR2DDR1

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