SCHEMBL29921279

SCHEMBL29921279

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-n1cc(-c2cnc3c(N)ncnn23)cn1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 8/20 0.63
▸ BCR P11274 8/20 0.63
▸ GPR142 Q7Z601 1/20 0.52
▸ CSF1R P07333 1/20 0.52
▸ RAF1 P04049 1/20 0.51
▸ BRAF P15056 1/20 0.51
▸ KDR P35968 7/20 0.50
▸ LCK P06239 4/20 0.50
▸ KIT P10721 3/20 0.50
▸ MAPK14 Q16539 3/20 0.50
▸ EPHB4 P54760 1/20 0.50
▸ TEK Q02763 2/20 0.49
▸ PDGFRB P09619 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ SRC P12931 1/20 0.47

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
SCHEMBL29071524 1.00 ABL1 (0.63) ABL1BCRGPR142CSF1RRAF1
SCHEMBL29921892 0.94 ABL1 (0.72) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29071349 0.94 ABL1 (0.72) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29921674 0.86 ABL1 (0.59) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29071240 0.86 ABL1 (0.59) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29071277 0.86 ABL1 (0.57) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29921977 0.86 ABL1 (0.61) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29071312 0.86 ABL1 (0.61) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29071512 0.85 ABL1 (0.60) ABL1BCRCSF1RRAF1BRAF
SCHEMBL29921869 0.85 ABL1 (0.60) ABL1BCRCSF1RRAF1BRAF

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116761801-A Heterocyclic compounds having protein kinase inhibitory activity, pharmaceutical compositions containing the same, and methods of preparing and using the same 四川科伦博泰生物医药股份有限公司 2023-09-15 — — CN disclosed
WO-2022188792-A1 HETEROCYCLIC COMPOUND HAVING PROTEIN KINASE INHIBITORY ACTIVITY, PHARMACEUTICAL COMPOSITION COMPRISING SAME, PREPARATION METHOD THEREFOR, AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2022-09-15 — — WO disclosed
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