SCHEMBL24944982

SCHEMBL24944982

CNc1nc(Nc2cc(C)nc(C)c2)c(C(N)=O)nc1-c1cncc2c1ncn2C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 2/20 0.37
▸ EML4 Q9HC35 1/20 0.33
▸ ALK Q9UM73 1/20 0.33
▸ SYK P43405 2/20 0.32
▸ PFKFB3 Q16875 1/20 0.31
▸ LRRK2 Q5S007 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
SCHEMBL30205499 1.00 TYK2 (0.37) TYK2EML4ALKSYKPFKFB3
SCHEMBL24944179 0.92 LRRK2 (0.33) TYK2EML4ALKSYKLRRK2
SCHEMBL30205755 0.92 LRRK2 (0.33) TYK2EML4ALKSYKLRRK2
SCHEMBL30206301 0.92 TYK2 (0.31) TYK2
SCHEMBL24944480 0.92 TYK2 (0.31) TYK2
SCHEMBL24944974 0.91 ALK (0.34) TYK2EML4ALKSYKPFKFB3
SCHEMBL29173474 0.90 HPGD (0.32) TYK2
SCHEMBL30205968 0.90 HPGD (0.32) TYK2
SCHEMBL24944445 0.89 SYK (0.31) EML4ALKSYK
SCHEMBL30205684 0.89 SYK (0.31) EML4ALKSYK

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
CN-117693503-A Substituted pyrazine-2-carboxamides as HPK1 inhibitors for the treatment of cancer 阿斯利康(瑞典)有限公司 2024-03-12 — — CN claimed
CN-117693503-A Substituted pyrazine-2-carboxamides as HPK1 inhibitors for the treatment of cancer 阿斯利康(瑞典)有限公司 2024-03-12 — — CN disclosed
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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