SCHEMBL6420451

SCHEMBL6420451

CCCCC(CC)COC(=O)OOOOC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.55
TSHR P16473 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
ATM Q13315 1/20 0.55
ALDH1A1 P00352 6/20 0.49
CA2 P00918 4/20 0.49
RECQL P46063 1/20 0.47
LMNA P02545 3/20 0.45
MAPK1 P28482 3/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
CA1 P00915 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
SCHEMBL93541 0.94 CYP3A4 (0.62) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL30089190 0.90 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL35432 0.90 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL35431 0.87 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL10975337 0.85 CYP3A4 (0.53) CYP3A4TSHRTDP1ATMALDH1A1
Hydrogen Peroxide SCHEMBL28532747 0.85 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL19348249 0.84 CYP3A4 (0.51) CYP3A4TSHRTDP1ATMALDH1A1
Bicarbonate SCHEMBL9302535 0.83 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL3478363 0.83 CYP3A4 (0.54) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL94797 0.83 CYP3A4 (0.70) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0907976-A4 COPOLYMERS OF VINYLIDENE FLUORIDE AND HEXAFLUOROPROPYLENE HAVING REDUCED EXTRACTABLE CONTENT AND IMPROVED SOLUTION CLARITY ARKEMA INC (US) 2005-11-02 EP disclosed
EP-0907976-A1 COPOLYMERS OF VINYLIDENE FLUORIDE AND HEXAFLUOROPROPYLENE HAVING REDUCED EXTRACTABLE CONTENT AND IMPROVED SOLUTION CLARITY ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-04-14 EP disclosed
WO-1998038687-A1 COPOLYMERS OF VINYLIDENE FLUORIDE AND HEXAFLUOROPROPYLENE HAVING REDUCED EXTRACTABLE CONTENT AND IMPROVED SOLUTION CLARITY ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-09-03 WO disclosed
US-4614572-A METHYLENE CHLORIDE THE DOW CHEMICAL COMPANY (US) 1986-09-30 US disclosed
EP-0043819-A4 EMULSION POLYMERIZATION PROCESS WITH LOW EMULSIFIER CONCENTRATION. GOODRICH CO B F (US) 1982-05-28 EP disclosed
EP-0043819-A1 EMULSION POLYMERIZATION PROCESS WITH LOW EMULSIFIER CONCENTRATION. GOODRICH CO B F (US) 1982-01-20 EP disclosed
US-4289667-A VINYL HALIDE POLYMERS; REDUCED POLYMER BUILDUP IN REACTOR THE B. F. GOODRICH COMPANY (US) 1981-09-15 US disclosed
WO-1981002158-A1 EMULSION POLYMERIZATION PROCESS WITH LOW EMULSIFIER CONCENTRATION GOODRICH CO B F (US) 1981-08-06 WO disclosed