SCHEMBL8405322

SCHEMBL8405322

CCOC(=O)c1cnc2c(N3CCCCC3)nccc2c1Nc1ccccc1C

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
TP53 P04637 2/20 0.52
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
THRB P10828 1/20 0.52
ATP4A P20648 1/20 0.48
ATP4B P51164 1/20 0.48

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
SCHEMBL8407040 0.91 MAPT (0.64) MAPTTP53GAAMAPK1SMN1; SMN2
SCHEMBL8405204 0.82 TP53 (0.56) MAPTTP53THRBATP4AATP4B
SCHEMBL11250615 0.81 TP53 (0.66) MAPTTP53THRBATP4AATP4B
SCHEMBL7848455 0.80 TP53 (0.71) MAPTTP53THRBATP4AATP4B
Hydrochloric Acid SCHEMBL11246958 0.80 TP53 (0.65) MAPTTP53THRBATP4AATP4B
SCHEMBL8405331 0.78 HPGD (0.44) MAPTTP53GAAMAPK1SMN1; SMN2
SCHEMBL11233814 0.77 THRB (0.68) THRBATP4AATP4B
SCHEMBL11235536 0.77 TP53 (0.62) MAPTTP53ATP4AATP4B
SCHEMBL7847409 0.77 ATP4A (0.78) ATP4AATP4B
Hydrochloric Acid SCHEMBL11233088 0.77 THRB (0.67) THRBATP4AATP4B

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
US-5952504-A REACTING A SULFONATED, HALOGENATED OR PHOSPHONATED 1,7-NAPHTHYRIDINE COMPOUNDS WITH AN AROMATIC AMINE DERIVATIVE; ANTIULCER AGENT YUNGJIN PHARMACEUTICAL COMPANY, LTD. (KR) 1999-09-14 US disclosed
EP-0843677-A1 4-AMINO-3-ACYLNAPHTHYRIDINE DERIVATIVES YUNGJIN PHARMACEUTICAL CO., LTD. (KR) 1998-05-27 EP disclosed
WO-1997003074-A1 4-AMINO-3-ACYLNAPHTHYRIDINE DERIVATIVES YUNGJIN PHARMACEUTICAL CO., LTD. (KR) 1997-01-30 WO disclosed