SCHEMBL26877838

SCHEMBL26877838

Nc1cccc(Nc2ccnc3[nH]c(=O)ccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 7/20 0.53
▸ ERBB2 P04626 5/20 0.53
▸ AURKA O14965 4/20 0.45
▸ AURKB Q96GD4 1/20 0.45
▸ SRC P12931 3/20 0.43
▸ EGFR P00533 3/20 0.43
▸ ABL1 P00519 2/20 0.43
▸ BCR P11274 2/20 0.43
▸ ACVR1 Q04771 1/20 0.43
▸ ALK Q9UM73 1/20 0.43
▸ AURKC Q9UQB9 1/20 0.43
▸ PRKACA P17612 1/20 0.43
▸ PRKACG P22612 1/20 0.43
▸ PRKACB P22694 1/20 0.43
▸ TNNI3K Q59H18 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
Hydrochloric Acid SCHEMBL26679853 0.99 PTK6 (0.52) PTK6ERBB2AURKAAURKBSRC
Hydrochloric Acid SCHEMBL29691563 0.99 PTK6 (0.52) PTK6ERBB2AURKAAURKBSRC
SCHEMBL24600560 0.83 AURKA (0.59) PTK6ERBB2AURKAAURKBKDM4E
Hydrochloric Acid SCHEMBL29691550 0.83 TNNI3K (0.45) PTK6ERBB2AURKAAURKBSRC
Hydrochloric Acid SCHEMBL26679909 0.83 TNNI3K (0.45) PTK6ERBB2AURKAAURKBSRC
Hydrochloric Acid SCHEMBL26679818 0.82 AURKA (0.58) PTK6ERBB2AURKAAURKBKDM4E
Hydrochloric Acid SCHEMBL29691644 0.82 AURKA (0.58) PTK6ERBB2AURKAAURKBKDM4E
Hydrochloric Acid SCHEMBL26679902 0.81 PTK6 (0.41) PTK6ERBB2AURKASRCEGFR
SCHEMBL24600528 0.79 PTK6 (0.40) PTK6ERBB2AURKAAURKBSRC
SCHEMBL24600527 0.78 TNNI3K (0.41) PTK6ERBB2AURKASRCEGFR

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
CN-116669726-A Novel naphthyridinone derivatives having inhibitory activity against exonuclease-phosphodiesterase and use thereof 谛希诺生物科技有限公司 2023-08-29 — — CN claimed
CN-116669726-A Novel naphthyridinone derivatives having inhibitory activity against exonuclease-phosphodiesterase and use thereof 谛希诺生物科技有限公司 2023-08-29 — — CN disclosed
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