SCHEMBL7944852

SCHEMBL7944852

CC(C)(C)c1cc(CCC(=O)NCCO)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
GAA P10253 3/20 0.58
MEN1 O00255 2/20 0.50
MAOA P21397 1/20 0.47
ACHE P22303 1/20 0.47
MAOB P27338 1/20 0.47
MAPT P10636 2/20 0.46
TRPV1 Q8NER1 2/20 0.46
HSD17B10 Q99714 1/20 0.46
PCNA P12004 1/20 0.45
CNR2 P34972 1/20 0.44
PYGL P06737 1/20 0.44
ERCC1 P07992 1/20 0.43
ERCC4 Q92889 1/20 0.43
ALOX12 P18054 1/20 0.43

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
SCHEMBL7942336 0.92 KMT2A (0.55) KMT2AGAAMEN1MAOAACHE
SCHEMBL7941189 0.91 KMT2A (0.54) KMT2AGAAMEN1MAOAACHE
SCHEMBL9677227 0.90 KMT2A (0.59) KMT2AGAAMEN1MAOAACHE
SCHEMBL8030232 0.90 KMT2A (0.53) KMT2AGAAMEN1MAOAACHE
SCHEMBL924084 0.89 KMT2A (0.58) KMT2AGAAMEN1MAOAACHE
SCHEMBL8605886 0.88 GAA (0.56) KMT2AGAAMEN1MAOAACHE
SCHEMBL4569531 0.87 GAA (0.70) KMT2AGAAMEN1MAOAACHE
SCHEMBL8606711 0.86 KMT2A (0.54) KMT2AGAAMEN1MAOAACHE
SCHEMBL22540654 0.85 GAA (0.67) KMT2AGAAMEN1MAOAACHE
SCHEMBL3919940 0.85 GAA (0.79) KMT2AGAAMEN1MAOAACHE

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 3 patents. 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
US-6075159-A USE AS A STABILIZER FOR AN ORGANIC MATERIAL SUCH AS THERMOPLASTIC RESINS, THERMOSETTING RESINS, NATURAL OR SYNTHETIC RUBBERS, MINERAL OILS, LUBRICATING OILS, ADHESIVES AND PAINTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-06-13 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed