SCHEMBL7792463

SCHEMBL7792463

COc1c(CC(=O)O)cccc1C(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 4/20 0.55
MMP2 P08253 4/20 0.43
MMP12 P39900 4/20 0.43
MMP8 P22894 3/20 0.43
MMP13 P45452 3/20 0.43
MMP14 P50281 3/20 0.43
MMP16 P51512 3/20 0.43
MMP9 P14780 3/20 0.42
AKR1B1 P15121 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
MMP1 P03956 1/20 0.41
MMP3 P08254 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
STING1 Q86WV6 1/20 0.40
TNFRSF1A P19438 1/20 0.40
PTGS2 P35354 2/20 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
SCHEMBL24725131 0.86 PTGS2 (0.49) NR1H4MMP2MMP12MMP8MMP13
SCHEMBL30100028 0.86 PTGS2 (0.49) NR1H4MMP2MMP12MMP8MMP13
SCHEMBL7796121 0.84 NR1H4 (0.44) NR1H4AKR1B1TDP1FABP4FABP5
SCHEMBL7796396 0.84 NR1H4 (0.47) NR1H4TNFRSF1A
SCHEMBL9079419 0.84 AKR1B1 (0.52) MMP2MMP12MMP8MMP13MMP14
SCHEMBL3235703 0.83 NR1H4 (0.43) NR1H4MMP2MMP12MMP8MMP13
SCHEMBL25450879 0.81 GABRA1 (0.43) NR1H4TDP1TNFRSF1A
SCHEMBL12477045 0.80 PTGDR2 (0.47) NR1H4MMP2MMP12MMP8MMP13
SCHEMBL16154153 0.80 CA2 (0.42) NR1H4TDP1TNFRSF1A
SCHEMBL3852706 0.79 AKR1B1 (0.55) NR1H4MMP2MMP12MMP8MMP13

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823435-B1 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL CO (JP) 2001-11-21 EP disclosed
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-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
US-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed