SCHEMBL31577349

SCHEMBL31577349

CNc1nc(Nc2ccc(CN3C[C@H]4C[C@@H]3CO4)cc2F)c(C(=O)O)nc1-c1cncc2c1ncn2C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 1/20 0.36
▸ LRRK2 Q5S007 3/20 0.35
▸ CCNC P24863 2/20 0.34
▸ CDK8 P49336 2/20 0.34
▸ BRAF P15056 2/20 0.33
▸ WNT3A P56704 1/20 0.32
▸ METTL3 Q86U44 1/20 0.31
▸ WNT1 P04628 2/20 0.31
▸ GSK3B P49841 2/20 0.31
▸ DYRK1A Q13627 2/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ IDH1 O75874 1/20 0.31
▸ MTOR P42345 1/20 0.30
▸ KIF11 P52732 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
SCHEMBL24944495 0.94 TLR7 (0.37) TLR7LRRK2CCNCCDK8BRAF
SCHEMBL30206277 0.94 LRRK2 (0.37) TLR7LRRK2CCNCCDK8BRAF
SCHEMBL30206282 0.94 LRRK2 (0.37) TLR7LRRK2CCNCCDK8BRAF
SCHEMBL24944493 0.94 TLR7 (0.37) TLR7LRRK2CCNCCDK8BRAF
SCHEMBL30206258 0.94 TLR7 (0.37) TLR7LRRK2CCNCCDK8BRAF
SCHEMBL24944781 0.94 TLR7 (0.37) TLR7LRRK2CCNCCDK8BRAF
SCHEMBL30205936 0.94 TLR7 (0.37) TLR7LRRK2CCNCCDK8BRAF
SCHEMBL24944780 0.83 LRRK2 (0.34) TLR7LRRK2CCNCCDK8
SCHEMBL30206270 0.83 LRRK2 (0.36) TLR7LRRK2CCNCCDK8WNT3A
SCHEMBL30205960 0.83 LRRK2 (0.34) TLR7LRRK2CCNCCDK8

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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