SCHEMBL7463239

SCHEMBL7463239

[CH2]CCCCCc1ccccc1SC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.49
LIPG Q9Y5X9 1/20 0.37
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 3/20 0.33
SLC6A2 P23975 3/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 2/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
APOBEC3G Q9HC16 1/20 0.31
CYSLTR2 Q9NS75 1/20 0.31
CYSLTR1 Q9Y271 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
KDM4E B2RXH2 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
HPGD P15428 1/20 0.30
MGLL Q99685 1/20 0.30

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
SCHEMBL7472978 0.98 CHRM2 (0.46) CHRM2LIPGALDH1A1MAPTL3MBTL1
SCHEMBL6602164 0.92 CHRM2 (0.47) CHRM2LIPGALDH1A1MAPTL3MBTL1
SCHEMBL6766462 0.77 CHRM2 (0.47) CHRM2ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL10665166 0.77 CHRM2 (0.47) CHRM2LIPGALDH1A1MAPTL3MBTL1
SCHEMBL712392 0.76 MAPT (0.54) MAPTCYSLTR2CYSLTR1RXFP1
SCHEMBL4801748 0.76 CHRM2 (0.48) CHRM2ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL1610409 0.75 TAAR1 (0.52) CHRM2LIPGMGLL
SCHEMBL11647220 0.75 LIPG (0.58) LIPGMAPTTHRATHRBCYSLTR2
SCHEMBL1610545 0.75 TAAR1 (0.52) CHRM2LIPGMGLL
SCHEMBL1610239 0.75 TAAR1 (0.52) CHRM2LIPGMGLL

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 6 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
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