SCHEMBL11263458

SCHEMBL11263458

CN(C(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1CCCCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SLC16A3 O15427 1/20 0.43
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
LTB4R Q15722 2/20 0.39
F13A1 P00488 3/20 0.38
MAPT P10636 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL11260711 0.96 GPBAR1 (0.46) GPBAR1PTGDR2SLC6A2SLC6A4SLC6A3
SCHEMBL11260689 0.92 GPBAR1 (0.47) GPBAR1PTGDR2SLC6A2SLC6A4SLC6A3
SCHEMBL11259485 0.87 LTB4R (0.44) ALDH1A1TMEM97SIGMAR1LTB4RMAPT
SCHEMBL3337091 0.86 GPBAR1 (0.38) GPBAR1PTGDR2SLC6A2SLC6A4SLC6A3
Benzylamine SCHEMBL11271042 0.84 GPBAR1 (0.44) GPBAR1PTGDR2SLC6A2SLC6A4SLC6A3
SCHEMBL11255842 0.83 ALDH1A1 (0.40) SLC6A3ALDH1A1TMEM97SIGMAR1LTB4R
SCHEMBL11257623 0.81 HDAC3 (0.45) SLC6A3ALDH1A1KDM4ELTB4RMAPT
SCHEMBL11267339 0.80 POLB (0.43) GPBAR1PTGDR2SLC6A4TSHRALDH1A1
SCHEMBL11267185 0.79 GPBAR1 (0.48) GPBAR1ALDH1A1
SCHEMBL11503510 0.79 GPBAR1 (0.44) GPBAR1PTGDR2SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0003532-B1 OMEGA-(2-(N-LOWER ALKYL-BENZAMIDO)-PHENYL)-ALKANOIC ACIDS, THEIR USE AND PREPARATION, AND MEDICAMENTS CONTAINING THEM Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1982-04-28 EP disclosed
US-4322439-A ω-[2-(N-Lower alkyl-benzamido)-phenyl]-alkanoic acids, their use, and medicaments containing them BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-03-30 US disclosed
WO-1979000586-A1 W-(2-N-LOWER ALKYL-BENZAMIDO)-PHENYL)-ALKANOIC ACIDS,THEIR USE AND PREPARATION,AND MEDICAMENTS CONTAINING THEM BYK GULDEN LOMBERG CHEM FAB (DE) 1979-08-23 WO disclosed
EP-0003532-A1 Omega-(2-(N-lower alkyl-benzamido)-phenyl)-alkanoic acids, their use and preparation, and medicaments containing them Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1979-08-22 EP disclosed