SCHEMBL7944740

SCHEMBL7944740

CC(C)(C)c1cccc(CCC(=O)NCCO)c1O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.45
CA2 P00918 1/20 0.42
IAPP P10997 4/20 0.41
CNR2 P34972 3/20 0.41
MAOA P21397 1/20 0.40
ACHE P22303 1/20 0.40
MAOB P27338 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ATM Q13315 1/20 0.39
CNR1 P21554 2/20 0.38
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 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
SCHEMBL7933754 0.92 GAA (0.46) GAAKMT2AMEN1CA2IAPP
SCHEMBL7941452 0.91 GAA (0.45) GAAKMT2AMEN1CA2IAPP
SCHEMBL7933906 0.90 KMT2A (0.44) GAAKMT2AMEN1CA2IAPP
SCHEMBL8606484 0.88 GAA (0.47) GAAKMT2AMEN1CA2IAPP
SCHEMBL8608450 0.86 KMT2A (0.45) GAAKMT2AMEN1CA2IAPP
SCHEMBL8030249 0.81 CA2 (0.42) GAAKMT2AMEN1CA2IAPP
SCHEMBL8608448 0.81 GAA (0.40) GAAKMT2AMEN1CA2IAPP
SCHEMBL7941083 0.80 GAA (0.53) GAAKMT2AMEN1CA2CNR2
SCHEMBL7943069 0.80 GAA (0.53) GAAKMT2AMEN1CNR2MAOA
SCHEMBL30501159 0.78 CA2 (0.52) CA2IAPPNPSR1ATMGABRA1

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