SCHEMBL8005053

SCHEMBL8005053

CCCCCCCC/C=C\CCCCCCCCOCC(COCCCCCCCC/C=C\CCCCCCCC)NC(=S)OCCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.44
LPAR3 Q9UBY5 3/20 0.44
PLA2G2C Q5R387 4/20 0.41
LPAR2 Q9HBW0 1/20 0.38
DNM1 Q05193 1/20 0.38
SPHK1 Q9NYA1 1/20 0.37
LSS P48449 1/20 0.37

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
SCHEMBL8005061 1.00 LPAR1 (0.44) LPAR1LPAR3PLA2G2CLPAR2DNM1
SCHEMBL8013032 0.89 LPAR1 (0.44) LPAR1LPAR3PLA2G2CLPAR2
SCHEMBL8013028 0.89 LPAR1 (0.44) LPAR1LPAR3PLA2G2CLPAR2
SCHEMBL8016676 0.87 LPAR1 (0.42) LPAR1LPAR3PLA2G2CLPAR2
SCHEMBL8016665 0.87 LPAR1 (0.42) LPAR1LPAR3PLA2G2CLPAR2
SCHEMBL8156016 0.86 PLA2G2C (0.46) LPAR1LPAR3PLA2G2CDNM1
SCHEMBL8004013 0.86 PLA2G2C (0.46) LPAR1LPAR3PLA2G2CDNM1
SCHEMBL8004002 0.86 PLA2G2C (0.46) LPAR1LPAR3PLA2G2CDNM1
SCHEMBL8013286 0.86 PLA2G2C (0.46) LPAR1LPAR3PLA2G2CDNM1
SCHEMBL8146592 0.86 PLA2G2C (0.46) LPAR1LPAR3PLA2G2CDNM1

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-0685234-B1 DRUG COMPOSITION CONTAINING NUCLEIC ACID COPOLYMER NIPPON SHINYAKU CO LTD (JP) 2000-05-10 EP disclosed
US-6020317-A Glycerol derivative, device and pharmaceutical composition NIPPON SHINYAKU CO. LTD. (JP) 2000-02-01 US disclosed
EP-0685457-B1 GLYCEROL DERIVATIVE, DEVICE AND PHARMACEUTICAL COMPOSITION NIPPON SHINYAKU CO LTD (JP) 1999-12-15 EP disclosed
US-5705188-A LIPID MIXTURE, ANTITUMOR AGENTS NIPPON SHINYAKU COMPANY, LTD. (JP) 1998-01-06 US disclosed
EP-0685457-A1 GLYCEROL DERIVATIVE, DEVICE AND PHARMACEUTICAL COMPOSITION NIPPON SHINYAKU COMPANY, LIMITED (JP) 1995-12-06 EP disclosed
EP-0685234-A1 DRUG COMPOSITION CONTAINING NUCLEIC ACID COPOLYMER NIPPON SHINYAKU COMPANY, LIMITED (JP) 1995-12-06 EP disclosed