SCHEMBL31577233

SCHEMBL31577233

CNc1nc(Nc2ccc(CN3CCC(F)(F)C3)cc2)cnc1-c1cncc2c1ncn2C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNC P24863 1/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ TLR7 Q9NYK1 5/20 0.33
▸ MELK Q14680 1/20 0.33
▸ CLK2 P49760 10/20 0.32
▸ CLK3 P49761 10/20 0.32
▸ DYRK1A Q13627 10/20 0.32
▸ PRKAA2 P54646 2/20 0.32
▸ WNT1 P04628 3/20 0.31
▸ PDGFRA P16234 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
SCHEMBL31577202 0.88 CDK1 (0.37) CCNCCDK8TLR7MELKPDGFRA
SCHEMBL31577264 0.85 HRH3 (0.33) TLR7PDGFRA
SCHEMBL31577208 0.85 HRH3 (0.33) TLR7PDGFRA
SCHEMBL24944427 0.84 CCNC (0.38) CCNCCDK8TLR7MELKCLK2
SCHEMBL31577218 0.82 CCNA2 (0.35) —
SCHEMBL31577243 0.82 CCNA2 (0.35) —
Formic Acid SCHEMBL29173318 0.82 CCNC (0.38) CCNCCDK8TLR7MELKCLK2
Formic Acid SCHEMBL30205548 0.82 CCNC (0.38) CCNCCDK8TLR7MELKCLK2
SCHEMBL29173642 0.77 SYK (0.38) —
SCHEMBL29173404 0.76 MAPK10 (0.40) —

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 claimed
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