SCHEMBL7470362

SCHEMBL7470362

[CH2]CCCc1ccccc1OCCCCC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 9/20 0.62
LTB4R2 Q9NPC1 5/20 0.62
PPARD Q03181 3/20 0.46
PPARA Q07869 3/20 0.46
LMNA P02545 1/20 0.45
CYP2C9 P11712 1/20 0.45
DHFR P00374 1/20 0.45
FABP4 P15090 1/20 0.44
KCNH2 Q12809 1/20 0.43
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43

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
SCHEMBL25168636 0.83 LTB4R (0.77) LTB4RLTB4R2PPARALMNA
SCHEMBL3034705 0.80 HTR1A (0.51) LMNACYP2C9DHFRKCNH2PTGER1
SCHEMBL7089438 0.80 LTB4R (0.55) LTB4RLTB4R2LMNACYP2C9DHFR
SCHEMBL22915184 0.80 LTB4R (0.66) LTB4RLTB4R2PPARDLMNADHFR
SCHEMBL8162525 0.79 LMNA (0.62) LTB4RLTB4R2PPARALMNAFABP4
SCHEMBL8163174 0.79 LMNA (0.62) LTB4RLTB4R2PPARALMNAFABP4
SCHEMBL8148742 0.79 LMNA (0.62) LTB4RLTB4R2PPARALMNAFABP4
SCHEMBL8151680 0.79 LMNA (0.62) LTB4RLTB4R2PPARALMNAFABP4
SCHEMBL8161670 0.79 LMNA (0.62) LTB4RLTB4R2PPARALMNAFABP4
SCHEMBL8158709 0.79 LMNA (0.62) LTB4RLTB4R2PPARALMNAFABP4

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