SCHEMBL7933901

SCHEMBL7933901

CC(CO)(CO)NC(=O)c1cccc(C(C)(C)C)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.48
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
KMT2A Q03164 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MEN1 O00255 2/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALOX5 P09917 3/20 0.35
PTGS2 P35354 2/20 0.35
PTGS1 P23219 1/20 0.35
PTPN5 P54829 1/20 0.35

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
SCHEMBL7941478 0.84 CA2 (0.44) CA2GABRA1GABRB2KMT2ANPSR1
SCHEMBL7933531 0.79 NR5A2 (0.59) CA2KMT2ANPSR1MEN1NR5A2
SCHEMBL8018882 0.79 ALDH1A1 (0.49) CA2KMT2ANPSR1MEN1NR5A2
Bromide SCHEMBL6847028 0.79 CA2 (0.53) CA2GABRA1GABRB2NPSR1ALOX12
SCHEMBL7940297 0.78 CA2 (0.48) CA2GABRA1GABRB2KMT2ANPSR1
SCHEMBL8030249 0.76 CA2 (0.42) CA2GABRA1GABRB2KMT2ANPSR1
SCHEMBL14552910 0.76 KMT2A (0.50) KMT2ANPSR1MEN1MAPTKDM4E
SCHEMBL28580133 0.75 MEN1 (0.56) CA2KMT2ANPSR1MEN1ALOX12
SCHEMBL18614009 0.75 NR5A2 (0.55) CA2GABRA1GABRB2KMT2ANR5A2
SCHEMBL6851744 0.74 CA2 (0.61) CA2GABRA1GABRB2NPSR1ALOX12

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