SCHEMBL7933780

SCHEMBL7933780

CCN(C(=O)CCc1cccc(C(C)(C)C)c1O)C(C)(CO)CO

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IAPP P10997 4/20 0.42
CA2 P00918 1/20 0.39
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATM Q13315 1/20 0.34
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
NLRP3 Q96P20 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
ALOX12 P18054 1/20 0.31
HSPA5 P11021 1/20 0.31

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
SCHEMBL7942438 0.88 IAPP (0.40) IAPPCA2GABRA1GABRB2KMT2A
SCHEMBL7943164 0.85 CA2 (0.41) IAPPCA2GABRA1GABRB2KMT2A
SCHEMBL7942411 0.84 CA2 (0.40) IAPPCA2GABRA1GABRB2KMT2A
SCHEMBL7941124 0.82 HSPA5 (0.49) CA2KMT2AMEN1ATMLMNA
SCHEMBL7944883 0.81 CYP2C19 (0.38) KMT2AMEN1HTTATMLMNA
SCHEMBL7940075 0.81 HTT (0.41) IAPPCA2GABRA1GABRB2KMT2A
SCHEMBL7943048 0.80 IAPP (0.42) IAPPCA2GABRA1GABRB2KMT2A
SCHEMBL8028674 0.79 IAPP (0.41) IAPPCA2GABRA1GABRB2ATM
SCHEMBL7944834 0.78 IAPP (0.40) IAPPCA2GABRA1GABRB2KMT2A
SCHEMBL7943231 0.78 GAA (0.51) KMT2AMEN1HTTATMLMNA

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