SCHEMBL11270174

SCHEMBL11270174

CCCOCC(CCO)OC(CCO)COCCC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
HSD17B10 Q99714 1/20 0.46
HTT P42858 2/20 0.41
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
LPAR1 Q92633 7/20 0.36
LPAR3 Q9UBY5 7/20 0.36
LPAR5 Q9H1C0 4/20 0.36
LPAR2 Q9HBW0 4/20 0.36
LPAR6 P43657 3/20 0.36
LPAR4 Q99677 3/20 0.36
PLA2G2C Q5R387 2/20 0.35

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
SCHEMBL8120460 0.85 LPAR1 (0.46) USP2HSD17B10HTTTDP1MEN1
SCHEMBL11272278 0.82 ALDH1A1 (0.40) USP2HSD17B10HTTMEN1THRB
SCHEMBL490907 0.82 HTT (0.53) USP2HSD17B10HTTMEN1THRB
SCHEMBL8468010 0.81 TSHR (0.52) USP2HSD17B10HTTMEN1THRB
SCHEMBL16161494 0.79 MEN1 (0.60) USP2HTTMEN1THRBKMT2A
SCHEMBL11276459 0.79 ROCK2 (0.30) LPAR1LPAR3LPAR5LPAR2LPAR6
SCHEMBL11270177 0.78 USP2 (0.42) USP2HSD17B10HTTTDP1MEN1
SCHEMBL9736299 0.77 HSD17B10 (0.56) USP2HSD17B10HTTTDP1MEN1
SCHEMBL17612255 0.76 HSD17B10 (0.54) USP2HSD17B10HTTTDP1MEN1
SCHEMBL10435643 0.75 USP2 (0.69) USP2HSD17B10HTTMEN1THRB

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
US-4330452-A Plasticizers for polyvinylchloride comprising a reaction product of alkanedicarboxic acid and alkanolether THE DOW CHEMICAL COMPANY (US) 1982-05-18 US claimed
US-4330452-A Plasticizers for polyvinylchloride comprising a reaction product of alkanedicarboxic acid and alkanolether THE DOW CHEMICAL COMPANY (US) 1982-05-18 US disclosed