SCHEMBL9685026

SCHEMBL9685026

NC(=O)C1CN(Cc2ccccc2)CC1O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.63
GBA1 P04062 1/20 0.54
S1PR5 Q9H228 3/20 0.51
S1PR1 P21453 1/20 0.51
RORC P51449 1/20 0.47
SIRT1 Q96EB6 1/20 0.46
ALDH1A1 P00352 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
GRIN2B Q13224 1/20 0.45
TSHR P16473 1/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL4522412 0.87 FUCA1 (0.67) FUCA1GBA1S1PR5S1PR1RORC
SCHEMBL21806309 0.87 FUCA1 (0.54) FUCA1S1PR5ALDH1A1NPC1RAB9A
SCHEMBL3544810 0.87 ALDH1A1 (0.52) FUCA1S1PR5ALDH1A1NPC1RAB9A
SCHEMBL3544805 0.87 ALDH1A1 (0.52) FUCA1S1PR5ALDH1A1NPC1RAB9A
SCHEMBL3544813 0.87 ALDH1A1 (0.52) FUCA1S1PR5ALDH1A1NPC1RAB9A
SCHEMBL18652827 0.84 FUCA1 (0.63) FUCA1GBA1S1PR5S1PR1RORC
SCHEMBL27556877 0.84 ALDH1A1 (0.61) FUCA1ALDH1A1GAA
SCHEMBL500851 0.84 S1PR5 (0.48) FUCA1S1PR5S1PR1RORCSIRT1
SCHEMBL500852 0.84 S1PR5 (0.48) FUCA1S1PR5S1PR1RORCSIRT1
SCHEMBL500850 0.84 S1PR5 (0.48) FUCA1S1PR5S1PR1RORCSIRT1

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