SCHEMBL8030249

SCHEMBL8030249

CC(CO)(CO)NC(=O)CCc1cccc(C(C)(C)C)c1O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.42
IAPP P10997 4/20 0.41
GAA P10253 4/20 0.39
GABRA1 P14867 2/20 0.38
GABRB2 P47870 2/20 0.38
KMT2A Q03164 2/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
AGTR1 P30556 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALOX12 P18054 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
VNN1 O95497 1/20 0.33

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
SCHEMBL7933913 0.90 GAA (0.40) CA2IAPPGAAKMT2AMEN1
SCHEMBL7941106 0.86 IAPP (0.42) CA2IAPPGAAGABRA1GABRB2
SCHEMBL7944740 0.81 GAA (0.48) CA2IAPPGAAGABRA1GABRB2
SCHEMBL7944861 0.80 GAA (0.44) GAAKMT2AATMMEN1ALDH1A1
SCHEMBL7933847 0.80 HSPA5 (0.51) CA2GAAKMT2AATMMEN1
SCHEMBL7933754 0.79 GAA (0.46) CA2IAPPGAAKMT2AMEN1
SCHEMBL4975584 0.78 CA2 (0.52) CA2IAPPGABRA1GABRB2ATM
SCHEMBL30501159 0.78 CA2 (0.52) CA2IAPPGABRA1GABRB2ATM
SCHEMBL7941452 0.78 GAA (0.45) CA2IAPPGAAKMT2AMEN1
SCHEMBL3809080 0.77 CA2 (0.59) CA2IAPPGABRA1GABRB2ATM

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
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