SCHEMBL9685669

SCHEMBL9685669

CC(=O)O[C@@H]1CCN(Cc2ccccc2)C1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.60
MAOB P27338 2/20 0.58
ACHE P22303 2/20 0.50
SCN4A P35499 2/20 0.49

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
SCHEMBL3206960 1.00 BCHE (0.60) BCHEMAOBACHESCN4A
SCHEMBL2893650 1.00 BCHE (0.60) BCHEMAOBACHESCN4A
SCHEMBL19038337 0.92 BCHE (0.72) BCHEMAOBACHE
SCHEMBL4135213 0.91 BCHE (0.67) BCHEACHE
Hydrochloric Acid SCHEMBL9380707 0.90 BCHE (0.65) BCHEACHE
SCHEMBL11478274 0.89 BCHE (0.54) BCHEMAOB
SCHEMBL250507 0.88 BCHE (0.61) BCHEMAOB
SCHEMBL7301577 0.87 BCHE (0.57) BCHEMAOBSCN4A
SCHEMBL8915069 0.87 BCHE (0.57) BCHEMAOBSCN4A
SCHEMBL27315592 0.86 BCHE (0.61) BCHEMAOB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0288519-A4 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS 1992-04-15 EP disclosed
US-4965273-A Certain 1-tertiary-butyl-naphthyridone carboxylic acid derivatives anti-bacterial agents BRISTOL-MYERS COMPANY (US) 1990-10-23 US disclosed
US-4954507-A 1-tertiary-alkyl-substituted naphthyridine carboxylic acid antibacterial agents BRISTOL-MYERS COMPANY (US) 1990-09-04 US disclosed
EP-0288519-A1 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS Bristol-Myers Squibb Company (US) 1988-11-02 EP disclosed
EP-0266576-A2 1-Tert-alkyl-substituted naphthyridine and quinoline carboxylic acids as antibacterial agents Bristol-Myers Squibb Company (US) 1988-05-11 EP disclosed
WO-1988002627-A1 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS BRISTOL-MYERS COMPANY (US) 1988-04-21 WO disclosed