SCHEMBL31577303

SCHEMBL31577303

CNc1nc(Nc2cc(C)nc(OCCOC)c2)c(C(=O)OC)nc1-c1nc2ccncc2n1C

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.32
▸ JAK3 P52333 2/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ EGFR P00533 1/20 0.30
▸ NAMPT P43490 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL30206269 0.80 — —
SCHEMBL29173644 0.80 — —
SCHEMBL31577281 0.76 RPS6KA5 (0.41) JAK2JAK3TP53MAPTSMN1; SMN2
SCHEMBL31577393 0.75 TP53 (0.31) TP53
SCHEMBL31577323 0.75 NAMPT (0.30) NAMPT
SCHEMBL24944445 0.73 SYK (0.31) JAK3
SCHEMBL30205684 0.73 SYK (0.31) JAK3
SCHEMBL31577344 0.71 BRD4 (0.30) —
SCHEMBL31577373 0.70 JAK2 (0.43) JAK2JAK3
SCHEMBL31577284 0.70 LRRK2 (0.41) JAK2JAK3EGFR

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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