SCHEMBL8405204

SCHEMBL8405204

CCOC(=O)c1cnc2c(OC)nccc2c1Nc1ccccc1C

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.56
MAPT P10636 1/20 0.56
ATP4A P20648 1/20 0.56
ATP4B P51164 1/20 0.56
THRB P10828 1/20 0.56

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
SCHEMBL8408366 0.88 ATP4A (0.73) ATP4AATP4B
SCHEMBL8569446 0.87 ATP4A (0.55) ATP4AATP4B
SCHEMBL11250615 0.85 TP53 (0.66) TP53MAPTATP4AATP4BTHRB
SCHEMBL7847409 0.84 ATP4A (0.78) ATP4AATP4B
Hydrochloric Acid SCHEMBL11246958 0.84 TP53 (0.65) TP53MAPTATP4AATP4BTHRB
Hydrochloric Acid SCHEMBL11233459 0.84 ATP4A (0.76) ATP4AATP4B
SCHEMBL7848455 0.82 TP53 (0.71) TP53MAPTATP4AATP4BTHRB
SCHEMBL8405322 0.82 MAPT (0.52) TP53MAPTATP4AATP4BTHRB
SCHEMBL8405251 0.82 ATP4A (0.67) ATP4AATP4B
SCHEMBL11233814 0.81 THRB (0.68) ATP4AATP4BTHRB

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