SCHEMBL28862448

SCHEMBL28862448

CCO/C=C/c1ncnc(NCc2ccc(-c3cnn(C)c3)cc2)c1F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 1/20 0.41
▸ KIT P10721 11/20 0.40
▸ PDPK1 O15530 1/20 0.39
▸ RPS6KB1 P23443 1/20 0.39
▸ TP53 P04637 2/20 0.39
▸ IRAK1 P51617 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ LCK P06239 1/20 0.36
▸ CSF1R P07333 1/20 0.36
▸ PDGFRB P09619 1/20 0.36
▸ PDGFRA P16234 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ EGFR P00533 3/20 0.35
▸ ERBB2 P04626 3/20 0.35
▸ ERBB4 Q15303 1/20 0.35
▸ CCNC P24863 1/20 0.34
▸ CDK8 P49336 1/20 0.34

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
SCHEMBL29615564 1.00 MKNK1 (0.41) MKNK1KITPDPK1RPS6KB1TP53
SCHEMBL22918645 0.80 KIT (0.51) MKNK1KITLCKCSF1RPDGFRB
SCHEMBL29614180 0.80 KIT (0.51) MKNK1KITLCKCSF1RPDGFRB
SCHEMBL29709020 0.80 KIT (0.51) MKNK1KITLCKCSF1RPDGFRB
SCHEMBL22918729 0.72 EGFR (0.35) TP53EGFRERBB2
SCHEMBL28862431 0.72 PRMT5 (0.38) KITCSF1RCCNCCDK8
SCHEMBL29615433 0.72 PRMT5 (0.38) KITCSF1RCCNCCDK8
SCHEMBL22919004 0.68 KIT (0.71) KITLCKCSF1RPDGFRBPDGFRA
SCHEMBL22918855 0.68 KIT (0.33) MKNK1KITLCKCSF1RPDGFRB
SCHEMBL28862468 0.67 GPR55 (0.48) KIT

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
CN-114174293-A 4- (imidazo [1,2-a ] pyridin-3-yl) -pyrimidine derivatives 默克专利股份公司 2022-03-11 — — CN disclosed
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