SCHEMBL24626352

SCHEMBL24626352

Cc1cc(F)c(C(=O)Nc2ccc(C)c(C(F)(F)F)c2)cc1C#Cc1cnc(N)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 5/20 0.49
CSF1R P07333 2/20 0.48
CYP2C9 P11712 4/20 0.48
BRAF P15056 3/20 0.48
KDR P35968 5/20 0.45
LCK P06239 4/20 0.45
TEK Q02763 4/20 0.45
ABL1 P00519 4/20 0.43
BCR P11274 2/20 0.43
PDGFRB P09619 2/20 0.42
RAF1 P04049 1/20 0.42
FGFR1 P11362 2/20 0.42
JAK2 O60674 1/20 0.42
EPHB4 P54760 1/20 0.42
PTK2 Q05397 1/20 0.42
MAPK14 Q16539 1/20 0.42
FLT3 P36888 2/20 0.41
PDGFRA P16234 1/20 0.41
CYP2C19 P33261 1/20 0.41
LRRK2 Q5S007 1/20 0.41

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
SCHEMBL24626382 0.86 KIT (0.57) KITCSF1RCYP2C9BRAFKDR
SCHEMBL29675114 0.85 KIT (0.69) KITCYP2C9KDRABL1FGFR1
SCHEMBL24626345 0.85 KIT (0.69) KITCYP2C9KDRABL1FGFR1
SCHEMBL24626007 0.83 CSF1R (0.54) KITCSF1RCYP2C9BRAFKDR
SCHEMBL29675001 0.81 CSF1R (0.66) KITCSF1RCYP2C9KDRLCK
SCHEMBL24626070 0.81 CSF1R (0.66) KITCSF1RCYP2C9KDRLCK
SCHEMBL29675418 0.79 KIT (0.72) KITCYP2C9KDRABL1FGFR1
SCHEMBL24626254 0.79 KIT (0.72) KITCYP2C9KDRABL1FGFR1
SCHEMBL29675147 0.78 ABL1 (0.63) ABL1BCRSRC
SCHEMBL24626419 0.78 KIT (0.70) KITCYP2C9ABL1FGFR1FLT3

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-2022149855-A1 HETEROARYL-ETHYNYL DERIVATIVE COMPOUND AND USE THEREOF 주식회사 비투에스바이오 2022-07-14 WO disclosed