SCHEMBL10975337

SCHEMBL10975337

CCCCC(CC)COC(=O)OOC(=O)O.CCCCOC(=O)OOC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.53
TSHR P16473 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
ATM Q13315 2/20 0.53
ALDH1A1 P00352 6/20 0.47
CA2 P00918 3/20 0.47
RECQL P46063 1/20 0.45
LMNA P02545 3/20 0.43
MAPK1 P28482 3/20 0.42
HSD17B10 Q99714 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP14 P50281 1/20 0.40
HCAR2 Q8TDS4 1/20 0.38

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
SCHEMBL35432 0.94 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL30089190 0.94 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL35431 0.87 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL30145368 0.86 CYP3A4 (0.50) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL6420451 0.85 CYP3A4 (0.55) CYP3A4TSHRTDP1ATMALDH1A1
Hydrogen Peroxide SCHEMBL29156813 0.84 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL3663925 0.83 CYP3A4 (0.53) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL1556513 0.83 CYP3A4 (0.57) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL11765553 0.83 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL28458985 0.83 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1

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
EP-0019372-B1 RUBBER MODIFIED METHYL METHACRYLATE SYRUPS, PRODUCTION AND USE IN PRODUCING CAST SHEETS AND MOULDING MATERIALS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-07-17 EP disclosed
EP-0019372-A2 Rubber modified methyl methacrylate syrups, production and use in producing cast sheets and moulding materials SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-11-26 EP disclosed