SCHEMBL24944992

SCHEMBL24944992

CNc1nc(Nc2ccc(N)c(F)c2F)c(C(N)=O)nc1-c1cncc2c1ncn2C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.33
▸ ABCB11 O95342 1/20 0.30
▸ NQO2 P16083 1/20 0.30
▸ MAP2K2 P36507 1/20 0.30
▸ MAP2K1 Q02750 1/20 0.30

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
SCHEMBL24944492 0.87 MAP2K2 (0.34) SYKABCB11NQO2MAP2K2MAP2K1
SCHEMBL24944991 0.86 SYK (0.30) SYK
SCHEMBL24944442 0.85 RET (0.37) SYKNQO2MAP2K2MAP2K1
SCHEMBL24944987 0.84 MAP2K2 (0.41) SYKABCB11NQO2MAP2K2MAP2K1
SCHEMBL30205495 0.83 LRRK2 (0.36) SYK
SCHEMBL24944784 0.83 LRRK2 (0.36) SYK
SCHEMBL29173320 0.83 GPR119 (0.35) ABCB11NQO2MAP2K2MAP2K1
SCHEMBL24944164 0.82 RET (0.36) SYKNQO2MAP2K2MAP2K1
SCHEMBL24944988 0.82 ABCB11 (0.33) SYKABCB11NQO2MAP2K2MAP2K1
SCHEMBL24943828 0.82 CDK2 (0.37) SYK

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
WO-2023001794-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2023-01-26 — — WO disclosed
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