SCHEMBL24626017

SCHEMBL24626017

Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc(N)cn1

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 8/20 0.82
▸ ABL1 P00519 11/20 0.76
▸ CSF1R P07333 1/20 0.71
▸ FGFR1 P11362 1/20 0.71
▸ KDR P35968 1/20 0.71
▸ SRC P12931 1/20 0.70
▸ FLT3 P36888 1/20 0.70

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
SCHEMBL29675112 1.00 KIT (0.82) KITABL1CSF1RFGFR1KDR
SCHEMBL13765822 0.93 KIT (0.71) KITABL1CSF1RFGFR1KDR
SCHEMBL15006468 0.92 KIT (0.70) KITABL1FGFR1FLT3
SCHEMBL4097590 0.90 ABL1 (0.74) KITABL1FGFR1FLT3
SCHEMBL19322509 0.90 KIT (0.79) KITABL1CSF1RFGFR1KDR
SCHEMBL22548956 0.90 ABL1 (0.82) KITABL1
SCHEMBL31620766 0.90 KIT (1.00) KITABL1FGFR1FLT3
SCHEMBL29675009 0.89 KIT (0.78) KITABL1CSF1RFGFR1KDR
SCHEMBL24626792 0.89 KIT (0.78) KITABL1CSF1RFGFR1KDR
SCHEMBL24626018 0.88 KIT (0.77) KITABL1CSF1RFGFR1KDR

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
Send feedback