SCHEMBL31577323

SCHEMBL31577323

CNc1nc(Nc2cc(C)nc(C#N)c2)c(C(N)=O)nc1-c1nc2ccncc2n1C

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.30
▸ BMPR2 Q13873 1/20 0.30
▸ TYK2 P29597 1/20 0.30
▸ CHEK2 O96017 1/20 0.30
▸ EML4 Q9HC35 1/20 0.30
▸ ALK Q9UM73 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
SCHEMBL31577339 0.79 BMI1 (0.37) TYK2CHEK2
SCHEMBL24944480 0.78 TYK2 (0.31) TYK2
SCHEMBL30206301 0.78 TYK2 (0.31) TYK2
SCHEMBL31577293 0.77 RPS6KA5 (0.41) NAMPTBMPR2TYK2CHEK2
SCHEMBL31577303 0.75 JAK2 (0.32) NAMPT
SCHEMBL31577359 0.73 BUB1 (0.33) —
SCHEMBL31577281 0.71 RPS6KA5 (0.41) —
SCHEMBL31577326 0.71 RPS6KA5 (0.37) NAMPTBMPR2CHEK2
SCHEMBL31577363 0.69 AOC3 (0.37) TYK2EML4ALK
SCHEMBL24944982 0.68 TYK2 (0.37) TYK2EML4ALK

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
EP-4373817-B1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2025-05-21 — — EP disclosed
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