SCHEMBL8018073

SCHEMBL8018073

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

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 3/20 0.48
LPAR1 Q92633 4/20 0.48
LPAR3 Q9UBY5 4/20 0.48
DNM1 Q05193 1/20 0.46
ACHE P22303 6/20 0.46
LPAR2 Q9HBW0 1/20 0.45

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
SCHEMBL8015698 1.00 TLR2 (0.48) TLR2LPAR1LPAR3DNM1ACHE
SCHEMBL8004574 1.00 TLR2 (0.48) TLR2LPAR1LPAR3DNM1ACHE
SCHEMBL8016912 1.00 TLR2 (0.48) TLR2LPAR1LPAR3DNM1ACHE
SCHEMBL8013946 0.93 EPHX2 (0.48) TLR2LPAR1LPAR3
SCHEMBL8013951 0.93 EPHX2 (0.48) TLR2LPAR1LPAR3
SCHEMBL3233852 0.93 EPHX2 (0.48) TLR2LPAR1LPAR3
SCHEMBL3233846 0.93 EPHX2 (0.48) TLR2LPAR1LPAR3
SCHEMBL8014158 0.90 CNR1 (0.47) TLR2
SCHEMBL8013487 0.90 CNR1 (0.47) TLR2
SCHEMBL24435889 0.88 LPAR1 (0.54) TLR2LPAR1LPAR3ACHELPAR2

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