SCHEMBL8014158

SCHEMBL8014158

CCCCC/C=C\C/C=C\CCCCCCCCOCC(COC(=O)NCCN(C)C)OCCCCCCCC/C=C\CCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.47
CNR2 P34972 2/20 0.47
ALDH1A1 P00352 1/20 0.47
EPHX2 P34913 2/20 0.46
TLR2 O60603 1/20 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
SCHEMBL8013487 1.00 CNR1 (0.47) CNR1CNR2ALDH1A1EPHX2TLR2
SCHEMBL3233852 0.97 EPHX2 (0.48) EPHX2TLR2
SCHEMBL8013946 0.97 EPHX2 (0.48) EPHX2TLR2
SCHEMBL3233846 0.97 EPHX2 (0.48) EPHX2TLR2
SCHEMBL8013951 0.97 EPHX2 (0.48) EPHX2TLR2
SCHEMBL8015732 0.95 CNR1 (0.41) CNR1CNR2ALDH1A1EPHX2TLR2
SCHEMBL8013982 0.92 EPHX2 (0.50) EPHX2TLR2
SCHEMBL8013985 0.92 EPHX2 (0.50) EPHX2TLR2
SCHEMBL8004617 0.91 EPHX2 (0.52) EPHX2
SCHEMBL8004611 0.91 EPHX2 (0.52) EPHX2

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