SCHEMBL24600560

SCHEMBL24600560

Nc1ccc(Nc2ccnc3[nH]c(=O)ccc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 9/20 0.59
▸ AURKB Q96GD4 2/20 0.59
▸ PDE3B Q13370 3/20 0.47
▸ PDE3A Q14432 3/20 0.47
▸ DNMT1 P26358 1/20 0.44
▸ ERBB2 P04626 1/20 0.41
▸ RAD52 P43351 1/20 0.39
▸ PTK6 Q13882 1/20 0.39
▸ MAPK13 O15264 1/20 0.38
▸ CHEK2 O96017 1/20 0.38
▸ NTRK1 P04629 1/20 0.38
▸ RET P07949 1/20 0.38
▸ HCK P08631 1/20 0.38
▸ FGFR1 P11362 1/20 0.38
▸ FLT4 P35916 1/20 0.38
▸ LIMK1 P53667 1/20 0.38
▸ SIK1 P57059 1/20 0.38
▸ TNK2 Q07912 1/20 0.38
▸ WNK3 Q9BYP7 1/20 0.38
▸ MAPT P10636 2/20 0.37

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 SCHEMBL29691644 0.99 AURKA (0.58) AURKAAURKBPDE3BPDE3ADNMT1
Hydrochloric Acid SCHEMBL26679818 0.99 AURKA (0.58) AURKAAURKBPDE3BPDE3ADNMT1
SCHEMBL24600630 0.85 AURKA (0.43) AURKAAURKBERBB2PTK6MAPK13
SCHEMBL26877838 0.83 PTK6 (0.53) AURKAAURKBERBB2PTK6MAPT
Hydrochloric Acid SCHEMBL26679864 0.83 AURKA (0.42) AURKAAURKBERBB2PTK6MAPK13
Hydrochloric Acid SCHEMBL29691552 0.83 AURKA (0.42) AURKAAURKBERBB2PTK6MAPK13
Hydrochloric Acid SCHEMBL26679897 0.82 AURKA (0.41) AURKAAURKBPDE3BPDE3AERBB2
Hydrochloric Acid SCHEMBL29691566 0.82 AURKA (0.41) AURKAAURKBPDE3BPDE3AERBB2
Hydrochloric Acid SCHEMBL29691563 0.82 PTK6 (0.52) AURKAAURKBERBB2PTK6MAPT
Hydrochloric Acid SCHEMBL26679853 0.82 PTK6 (0.52) AURKAAURKBERBB2PTK6MAPT

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 3 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
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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