SCHEMBL16743363

SCHEMBL16743363

CC[C@@H](Nc1nnc(C(N)=O)c(Nc2cccc(Cl)c2)n1)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 18/20 0.51
▸ KDM4E B2RXH2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ CDK5 Q00535 1/20 0.41
▸ CDK5R1 Q15078 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ KCNH2 Q12809 1/20 0.40

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
SCHEMBL16743153 0.89 SYK (0.59) SYKKCNH2
SCHEMBL16743307 0.88 SYK (0.51) SYK
SCHEMBL16743312 0.87 SYK (0.46) SYK
SCHEMBL16743243 0.87 SYK (0.48) SYK
SCHEMBL16743587 0.85 SYK (0.53) SYK
SCHEMBL16743326 0.85 SYK (0.53) SYK
SCHEMBL16743377 0.85 SYK (0.47) SYK
SCHEMBL16743351 0.85 SYK (0.47) SYKKDM4EMAPT
SCHEMBL16743205 0.84 SYK (0.73) SYKKCNH2
SCHEMBL16743321 0.83 SYK (0.49) SYKMAPT

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
US-9040530-B2 1,2,4-triazine-6-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2015-05-26 — — US disclosed
US-9040530-B2 1,2,4-triazine-6-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2015-05-26 — — US disclosed
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