SCHEMBL8016643

SCHEMBL8016643

CCCCCCCCCCCCOCC(COC(=O)CCCN(C)C)OCCCCCCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.55
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
LPAR1 Q92633 4/20 0.50
LPAR3 Q9UBY5 4/20 0.50
PRKCA P17252 3/20 0.48
PRKCE Q02156 1/20 0.48
PRKCQ Q04759 1/20 0.48
PRKCD Q05655 1/20 0.48
TLR2 O60603 2/20 0.47
LPAR2 Q9HBW0 1/20 0.47
MAPT P10636 1/20 0.46
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
ENPP2 Q13822 2/20 0.44

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
SCHEMBL8018297 0.93 CNR1 (0.54) DNM1LPAR1LPAR3PRKCAPRKCE
SCHEMBL3241354 0.93 CNR1 (0.54) DNM1LPAR1LPAR3PRKCAPRKCE
SCHEMBL3241357 0.93 CNR1 (0.54) DNM1LPAR1LPAR3PRKCAPRKCE
SCHEMBL8018295 0.93 CNR1 (0.54) DNM1LPAR1LPAR3PRKCAPRKCE
SCHEMBL10081497 0.90 DNM1 (0.51) DNM1ALDH1A1LMNALPAR1LPAR3
SCHEMBL8014156 0.90 CNR1 (0.59) ALDH1A1LPAR3PRKCAPRKCEPRKCQ
SCHEMBL8020444 0.90 CNR1 (0.59) ALDH1A1LPAR3PRKCAPRKCEPRKCQ
SCHEMBL10081496 0.90 DNM1 (0.51) DNM1ALDH1A1LMNALPAR1LPAR3
SCHEMBL8004615 0.90 PRKCA (0.56) DNM1LPAR1LPAR3PRKCAPRKCE
SCHEMBL8004619 0.90 PRKCA (0.56) DNM1LPAR1LPAR3PRKCAPRKCE

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 5 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
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