SCHEMBL27114602

SCHEMBL27114602

FC(F)(F)c1cncc(Nc2nccc(-c3cnc4nc[nH]c4c3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 2/20 0.45
▸ CLK1 P49759 3/20 0.43
▸ CLK2 P49760 2/20 0.43
▸ DYRK1A Q13627 2/20 0.43
▸ CLK4 Q9HAZ1 2/20 0.43
▸ DYRK1B Q9Y463 2/20 0.43
▸ MTOR P42345 1/20 0.41
▸ SMG1 Q96Q15 1/20 0.41
▸ SMO Q99835 1/20 0.41
▸ CDK2 P24941 5/20 0.40
▸ GSK3B P49841 3/20 0.40
▸ SYK P43405 5/20 0.39
▸ SRC P12931 4/20 0.39
▸ ZAP70 P43403 4/20 0.39
▸ CDK4 P11802 1/20 0.38
▸ AURKA O14965 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ ABL1 P00519 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ PRKCA P17252 1/20 0.37

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
SCHEMBL27115447 0.88 CLK1 (0.57) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL27113280 0.84 KIT (0.47) KITCLK1CLK2DYRK1ACLK4
SCHEMBL27144345 0.79 SYK (0.49) KITCLK1CLK2DYRK1ACLK4
SCHEMBL27115340 0.79 CDK2 (0.53) CDK2SRCCDK4ABL1EGFR
SCHEMBL27118927 0.76 CDK2 (0.50) KITCLK1CLK2DYRK1ACLK4
SCHEMBL27151879 0.76 GSK3B (0.53) KITCLK1CLK2DYRK1ACLK4
SCHEMBL27118928 0.76 ABL1 (0.61) DYRK1ASMG1CDK2SYKSRC
SCHEMBL27115203 0.76 ABL1 (0.61) MTORSMG1CDK2CDK4CDK1
SCHEMBL27115201 0.73 ABL1 (0.45) CLK1DYRK1ACLK4MTORSMG1
SCHEMBL27111699 0.73 CLK1 (0.62) CLK1CLK2DYRK1ACLK4DYRK1B

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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