SCHEMBL26953277

SCHEMBL26953277

Cc1cc(-c2ccnc3[nH]ccc23)cnc1CN

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 3/20 0.58
▸ AURKB Q96GD4 3/20 0.52
▸ AURKA O14965 2/20 0.52
▸ INCENP Q9NQS7 2/20 0.52
▸ TPX2 Q9ULW0 2/20 0.52
▸ IKBKB O14920 5/20 0.50
▸ CHUK O15111 5/20 0.50
▸ ROCK1 Q13464 2/20 0.50
▸ DAPK3 O43293 1/20 0.50
▸ JAK2 O60674 1/20 0.50
▸ PRKD3 O94806 1/20 0.50
▸ MAP4K4 O95819 1/20 0.50
▸ PAK4 O96013 1/20 0.50
▸ CSF1R P07333 1/20 0.50
▸ RET P07949 1/20 0.50
▸ IGF1R P08069 1/20 0.50
▸ FGFR1 P11362 1/20 0.50
▸ PRKACA P17612 1/20 0.50
▸ FLT1 P17948 1/20 0.50
▸ LTK P29376 1/20 0.50

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
SCHEMBL31734996 1.00 NUDT1 (0.58) NUDT1AURKBAURKAINCENPTPX2
SCHEMBL26953368 0.81 PRKCI (0.54) NUDT1AURKBIKBKBCHUKROCK1
SCHEMBL1717710 0.76 PRKCI (0.61) NUDT1AURKBAURKAINCENPTPX2
SCHEMBL26953081 0.74 PRKCI (0.48) NUDT1AURKBAURKAINCENPTPX2
SCHEMBL31734994 0.74 PRKCI (0.48) NUDT1AURKBAURKAINCENPTPX2
SCHEMBL4791464 0.74 IKBKB (0.64) NUDT1AURKBAURKAINCENPTPX2
SCHEMBL857132 0.73 IKBKB (0.63) NUDT1AURKBAURKAINCENPTPX2
SCHEMBL23496993 0.73 TLR8 (0.58) NUDT1AURKBIKBKBCHUKROCK1
SCHEMBL856991 0.73 PRKCI (0.57) NUDT1AURKBIKBKBCHUKROCK1
SCHEMBL4791235 0.72 NUDT1 (0.64) NUDT1AURKBAURKAINCENPTPX2

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
WO-2023239727-A1 LATS INHIBITORS AND USES THEREOF THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2023-12-14 — — WO disclosed
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