SCHEMBL24600505

SCHEMBL24600505

NSNc1cccc(-c2ccnc3[nH]c(=O)ccc23)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 10/20 0.42
▸ PRKCI P41743 1/20 0.42
▸ CHUK O15111 3/20 0.41
▸ IKBKB O14920 2/20 0.41
▸ MAPK8 P45983 2/20 0.40
▸ INSR P06213 1/20 0.40
▸ CAMKK2 Q96RR4 1/20 0.40
▸ PIK3C3 Q8NEB9 1/20 0.38
▸ CDK2 P24941 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ ENPP1 P22413 1/20 0.36
▸ CCNK O75909 1/20 0.36
▸ CDK12 Q9NYV4 1/20 0.36
▸ JAK3 P52333 2/20 0.36
▸ DAPK3 O43293 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ PRKD3 O94806 1/20 0.36
▸ MAP4K4 O95819 1/20 0.36

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
SCHEMBL29691588 0.83 ENPP1 (0.53) NUDT1PRKCICHUKIKBKBMAPK8
SCHEMBL24600506 0.83 ENPP1 (0.53) NUDT1PRKCICHUKIKBKBMAPK8
Hydrochloric Acid SCHEMBL29691657 0.82 ENPP1 (0.54) NUDT1PRKCICHUKIKBKBMAPK8
Hydrochloric Acid SCHEMBL26680014 0.82 ENPP1 (0.54) NUDT1PRKCICHUKIKBKBMAPK8
SCHEMBL26679983 0.81 NUDT1 (0.43) NUDT1PRKCICHUKIKBKBMAPK8
SCHEMBL24600955 0.81 CDK9 (0.47) NUDT1PRKCICHUKIKBKBMAPK8
Hydrochloric Acid SCHEMBL26680010 0.81 NUDT1 (0.42) NUDT1PRKCICHUKIKBKBMAPK8
SCHEMBL24600623 0.80 NUDT1 (0.40) NUDT1PRKCICHUKIKBKBMAPK8
SCHEMBL24600967 0.78 PRKCI (0.47) NUDT1PRKCICHUKIKBKBMAPK8
SCHEMBL29248795 0.77 CHUK (0.48) NUDT1PRKCICHUKIKBKBMAPK8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4276100-A1 NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF Txinno Bioscience Inc. (KR) 2023-11-15 — — EP disclosed
WO-2022146022-A1 NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF 주식회사 티씨노바이오사이언스 2022-07-07 — — WO disclosed
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