SCHEMBL10060730

SCHEMBL10060730

CCCCC/C=C\CCCCCCCCCCCOC[C@H](O)CCCCCCCCC

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.59
HTT P42858 1/20 0.57
LPAR1 Q92633 3/20 0.54
LPAR3 Q9UBY5 3/20 0.54
P2RY10 O00398 1/20 0.53
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
LPAR5 Q9H1C0 1/20 0.50
FFAR1 O14842 1/20 0.50
FFAR4 Q5NUL3 1/20 0.50
LPAR2 Q9HBW0 1/20 0.46

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
SCHEMBL27546870 0.97 USP2 (0.59) USP2HTTLPAR1LPAR3P2RY10
SCHEMBL903039 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL899536 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL17743870 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL903074 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL17744012 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL17147623 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL17743867 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL15315277 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3
SCHEMBL17744011 0.95 USP2 (0.54) USP2HTTLPAR1LPAR3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012044638-A1 LOW MOLECULAR WEIGHT CATIONIC LIPIDS FOR OLIGONUCLEOTIDE DELIVERY MERCK SHARP & DOHME CORP. (US) 2012-04-05 WO disclosed