SCHEMBL7466567

SCHEMBL7466567

[CH2]CCCCc1cccc(OCCCCCCN)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.44
PPARG P37231 2/20 0.44
PPARA Q07869 2/20 0.44
MAOA P21397 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
MGLL Q99685 1/20 0.42
PRSS1 P07477 2/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL8862906 0.88 MGLL (0.50) PPARGPPARAMAOACNR1CNR2
SCHEMBL3028864 0.88 MGLL (0.50) PPARGPPARAMAOACNR1CNR2
SCHEMBL9026456 0.88 MGLL (0.50) PPARGPPARAMAOACNR1CNR2
SCHEMBL3026378 0.87 PPARA (0.45) PPARGPPARACNR1CNR2MGLL
SCHEMBL7854103 0.85 PPARA (0.60) PPARGPPARACNR1CNR2TSHR
SCHEMBL3031825 0.85 PPARA (0.60) PPARGPPARACNR1CNR2TSHR
SCHEMBL3021697 0.85 PPARA (0.60) PPARGPPARACNR1CNR2TSHR
SCHEMBL9579218 0.85 PPARA (0.60) PPARGPPARACNR1CNR2TSHR
SCHEMBL8778537 0.84 PPARA (0.58) PPARGPPARACNR1CNR2TSHR
SCHEMBL3035008 0.84 PPARA (0.58) PPARGPPARACNR1CNR2TSHR

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