SCHEMBL7474657

SCHEMBL7474657

[CH2]CCc1ccc(OCCCC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.62
LMNA P02545 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
PPARG P37231 3/20 0.56
S1PR1 P21453 4/20 0.54
S1PR3 Q99500 2/20 0.54
FFAR4 Q5NUL3 2/20 0.51
S1PR5 Q9H228 1/20 0.51
PPARA Q07869 2/20 0.50
ESR1 P03372 1/20 0.50
PPARD Q03181 1/20 0.50
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 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
SCHEMBL7477690 0.84 FFAR1 (0.67) FFAR1LMNAL3MBTL1S1PR1S1PR3
SCHEMBL31448501 0.84 PPARA (0.65) FFAR1LMNAL3MBTL1FFAR4PPARA
SCHEMBL7565477 0.83 FFAR1 (0.67) FFAR1LMNAL3MBTL1PPARGS1PR1
SCHEMBL2556954 0.82 L3MBTL1 (0.67) FFAR1LMNAL3MBTL1PPARGS1PR1
SCHEMBL20799670 0.82 FFAR1 (0.65) FFAR1LMNAL3MBTL1PPARGS1PR1
SCHEMBL7556540 0.81 FFAR1 (0.56) FFAR1PPARGFFAR4PPARAPPARD
SCHEMBL11771388 0.81 ALOX15 (0.57) FFAR1PPARGFFAR4PPARAPPARD
SCHEMBL2891962 0.81 FFAR1 (0.58) FFAR1LMNAL3MBTL1PPARGFFAR4
SCHEMBL10728695 0.81 PLA2G4B (0.59) FFAR1LMNAL3MBTL1PPARGPPARA
SCHEMBL16686916 0.81 LMNA (0.69) FFAR1LMNAL3MBTL1S1PR1S1PR3

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 8 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
CN-1104412-A Peripheral Vasodilating agent containing N-acylated 4-amino piperidine derivatives as active ingredients OTSUKA PHARMA CO LTD (JP) 1995-06-28 CN 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