SCHEMBL7933913

SCHEMBL7933913

CC(CO)(CO)NC(=O)CCc1cccc(C(C)(C)C)c1O.CC(CO)(CO)NC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 1/20 0.40
AGTR1 P30556 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALOX5 P09917 2/20 0.38
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
KMT2A Q03164 3/20 0.38
CA2 P00918 1/20 0.37
MEN1 O00255 2/20 0.36
MAOB P27338 3/20 0.36
SYK P43405 1/20 0.35
ANO1 Q5XXA6 1/20 0.35
IAPP P10997 2/20 0.34
RECQL P46063 1/20 0.34
MAOA P21397 1/20 0.34

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
SCHEMBL8030249 0.90 CA2 (0.42) GAALMNAALDH1A1AGTR1HTT
SCHEMBL8018921 0.81 LMNA (0.49) GAALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL7941106 0.77 IAPP (0.42) GAALMNAALDH1A1AGTR1HTT
SCHEMBL7944861 0.77 GAA (0.44) GAALMNAALDH1A1AGTR1HTT
SCHEMBL7933847 0.77 HSPA5 (0.51) GAALMNAALDH1A1AGTR1HTT
SCHEMBL7933918 0.76 GAA (0.67) GAALMNAALDH1A1AGTR1HTT
SCHEMBL7944869 0.73 CYP1A2 (0.45) GAALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL7933901 0.73 CA2 (0.48) GAAALDH1A1ALOX5PTGS1PTGS2
SCHEMBL7944740 0.73 GAA (0.48) GAAKMT2ACA2MEN1MAOB
SCHEMBL10427578 0.72 CA2 (0.52) GAALMNAALDH1A1PTGS1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed