SCHEMBL11270177

SCHEMBL11270177

CCCOC(CCO)COCC(CCO)OCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
HTT P42858 2/20 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
LPAR1 Q92633 6/20 0.39
LPAR3 Q9UBY5 6/20 0.39
LPAR2 Q9HBW0 3/20 0.39
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
HSD17B10 Q99714 1/20 0.37
DNM1 Q05193 1/20 0.36
LPAR6 P43657 2/20 0.36
LPAR4 Q99677 2/20 0.36
LPAR5 Q9H1C0 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
SMN1; SMN2 Q16637 1/20 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
SCHEMBL3796999 0.86 TSHR (0.54) USP2HTTMEN1THRBKMT2A
SCHEMBL6658678 0.85 ALDH1A1 (0.46) USP2HTTMEN1THRBKMT2A
SCHEMBL13563001 0.83 TSHR (0.48) USP2HTTMEN1THRBKMT2A
SCHEMBL10375800 0.82 ALDH1A1 (0.35) USP2HTTMEN1THRBKMT2A
SCHEMBL11272282 0.82 THRB (0.39) USP2HTTMEN1THRBKMT2A
SCHEMBL7776041 0.82 TSHR (0.41) USP2HTTMEN1THRBKMT2A
SCHEMBL13377790 0.82 ALDH1A1 (0.35) USP2HTTMEN1THRBKMT2A
SCHEMBL16475723 0.82 LPAR1 (0.58) USP2HTTMEN1THRBKMT2A
SCHEMBL11300983 0.82 LPAR1 (0.58) USP2HTTMEN1THRBKMT2A
SCHEMBL18686256 0.82 LPAR1 (0.58) USP2HTTMEN1THRBKMT2A

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