SCHEMBL7474979

SCHEMBL7474979

[CH2]CCCCc1cccc(OCCCCCC(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.57
CYSLTR1 Q9Y271 1/20 0.57
CNR1 P21554 1/20 0.56
CNR2 P34972 1/20 0.56
PPARA Q07869 3/20 0.55
PPARG P37231 2/20 0.55
FFAR1 O14842 4/20 0.53
MAPT P10636 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
S1PR1 P21453 3/20 0.49
S1PR3 Q99500 1/20 0.49
S1PR5 Q9H228 1/20 0.49
PTGDR2 Q9Y5Y4 2/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
PTGDR Q13258 1/20 0.47
PLA2G4B P0C869 1/20 0.46

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
SCHEMBL7552344 0.91 FFAR1 (0.55) CYSLTR2CYSLTR1CNR1CNR2PPARA
SCHEMBL947863 0.89 FFAR1 (0.67) CYSLTR2CYSLTR1CNR1CNR2PPARA
SCHEMBL25456613 0.87 PPARA (0.74) CYSLTR2CYSLTR1CNR1CNR2PPARA
SCHEMBL4123448 0.87 PPARA (0.74) CYSLTR2CYSLTR1CNR1CNR2PPARA
SCHEMBL4112790 0.87 PPARA (0.74) CYSLTR2CYSLTR1CNR1CNR2PPARA
SCHEMBL27419819 0.87 PPARA (0.74) CYSLTR2CYSLTR1CNR1CNR2PPARA
SCHEMBL20945377 0.86 PPARA (0.58) CYSLTR2CYSLTR1CNR1CNR2PPARA
SCHEMBL7556540 0.86 FFAR1 (0.56) CYSLTR2CYSLTR1PPARAPPARGFFAR1
SCHEMBL8862906 0.86 MGLL (0.50) CNR1CNR2PPARAPPARGFFAR1
SCHEMBL3028864 0.86 MGLL (0.50) CNR1CNR2PPARAPPARGFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650476-B1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMA CO LTD (JP) 2002-06-26 EP disclosed
US-6136826-A AMINOPIPERIDINE COMPOUNDS SUBSTITUTED WITH ALKANOYL OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
CN-1052224-C Peripheral Vasodilating agent containing N-acylated 4-amino piperidine derivatives as active ingredients OTSUKA PHARMA CO LTD (JP) 2000-05-10 CN disclosed
US-5760058-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-06-02 US disclosed
US-5656642-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-12 US disclosed
EP-0650476-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-05-03 EP disclosed
WO-1994022826-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-13 WO disclosed