SCHEMBL7757196

SCHEMBL7757196

CCCCCOCC(O)C(O)COCCCCC

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.66
USP2 O75604 1/20 0.63
HTT P42858 2/20 0.61
MEN1 O00255 1/20 0.54
THRB P10828 1/20 0.54
KMT2A Q03164 1/20 0.54
MAPT P10636 1/20 0.54
LPAR5 Q9H1C0 4/20 0.52
TSHR P16473 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
LPAR1 Q92633 7/20 0.47
LPAR3 Q9UBY5 7/20 0.47
LPAR2 Q9HBW0 4/20 0.47
LPAR6 P43657 3/20 0.47
LPAR4 Q99677 3/20 0.47
HSD17B10 Q99714 1/20 0.46
PLA2G2C Q5R387 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
SCHEMBL29169783 0.98 SPHK1 (0.69) SPHK1USP2HTTMEN1THRB
SCHEMBL1506142 0.91 SPHK1 (0.62) SPHK1USP2HTTMEN1THRB
SCHEMBL11302893 0.91 SPHK1 (0.58) SPHK1USP2HTTMEN1THRB
SCHEMBL16187995 0.91 SPHK1 (0.62) SPHK1USP2HTTMEN1THRB
SCHEMBL11224040 0.91 SPHK1 (0.61) SPHK1USP2HTTMEN1THRB
SCHEMBL14880189 0.89 SPHK1 (0.61) SPHK1USP2HTTMEN1THRB
SCHEMBL9117099 0.89 SPHK1 (0.61) SPHK1USP2HTTMEN1THRB
SCHEMBL28128054 0.89 USP2 (0.69) SPHK1USP2HTTMEN1THRB
SCHEMBL16187998 0.89 USP2 (0.69) SPHK1USP2HTTMEN1THRB
SCHEMBL16187997 0.89 USP2 (0.69) SPHK1USP2HTTMEN1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2001158782-A METHOD FOR PRODUCING 1,3-DIOXOLANE DERIVATIVE MITSUBISHI CHEMICALS CORP 2001-06-12 JP disclosed
JP-2001151726-A METHOD FOR PRODUCING 1,4-BIS(ACYLOXY)-2,3-BUTANEDIOL AND ITS DERIVATIVE MITSUBISHI CHEMICALS CORP 2001-06-05 JP disclosed