SCHEMBL27115201

SCHEMBL27115201

CCc1cccc(Nc2nccc(-c3cnc4nc[nH]c4c3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 7/20 0.45
▸ BCR P11274 6/20 0.45
▸ CDK2 P24941 3/20 0.44
▸ CDK1 P06493 2/20 0.44
▸ CCNB2 O95067 1/20 0.44
▸ CCNB1 P14635 1/20 0.44
▸ CCNA2 P20248 1/20 0.44
▸ CCNA1 P78396 1/20 0.44
▸ CCNB3 Q8WWL7 1/20 0.44
▸ CDK5 Q00535 1/20 0.43
▸ CDK5R1 Q15078 1/20 0.43
▸ SRC P12931 4/20 0.43
▸ PIK3CA P42336 3/20 0.43
▸ PIK3CG P48736 3/20 0.43
▸ PIK3CB P42338 2/20 0.43
▸ PRKCA P17252 2/20 0.43
▸ PRKCD Q05655 2/20 0.43
▸ EGFR P00533 1/20 0.43
▸ PRKACA P17612 1/20 0.43
▸ PRKACG P22612 1/20 0.43

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
SCHEMBL27118925 0.92 ABL1 (0.45) ABL1BCRCDK2SRCPIK3CA
SCHEMBL27118928 0.86 ABL1 (0.61) ABL1BCRCDK2CDK1CCNB2
SCHEMBL27115340 0.85 CDK2 (0.53) ABL1BCRCDK2CCNA2CCNA1
SCHEMBL27115203 0.84 ABL1 (0.61) ABL1BCRCDK2CDK1CCNB1
SCHEMBL27118926 0.84 CAMK2D (0.46) ABL1BCRCDK5SRCPIK3CA
SCHEMBL27115447 0.82 CLK1 (0.57) CDK2CLK1DYRK1ACLK4CDK4
SCHEMBL27118927 0.78 CDK2 (0.50) ABL1BCRCDK2CDK1PIK3CA
SCHEMBL7528647 0.78 ABL1 (0.72) ABL1BCRSRCPRKCAPRKCD
SCHEMBL7467043 0.78 ABL1 (0.67) ABL1BCRCDK5CDK5R1SRC
SCHEMBL7464559 0.74 IKBKB (0.53) ABL1BCRCDK2CDK1CDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 — — WO claimed
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 — — WO disclosed
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 — — WO disclosed
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