SCHEMBL7940184

SCHEMBL7940184

COc1c(C(=O)OCCO)cc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 0.46
PPARG P37231 14/20 0.46
RARG P13631 6/20 0.46
KMT2A Q03164 1/20 0.37
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36
RARA P10276 3/20 0.35
RARB P10826 3/20 0.35
RXRB P28702 3/20 0.35
RXRG P48443 3/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TSHR P16473 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
SCHEMBL7942623 0.87 KMT2A (0.38) RXRAPPARGRARGKMT2AKDM4E
SCHEMBL7943266 0.86 RXRA (0.50) RXRAPPARGRARGKMT2ANR5A2
SCHEMBL7941341 0.86 ALDH1A1 (0.37) RXRAPPARGRARGKMT2AKDM4E
SCHEMBL7941411 0.83 NR5A2 (0.49) RXRAPPARGRARGNR5A2NR5A1
SCHEMBL5664156 0.82 RXRA (0.52) RXRAPPARGRARGNR5A2NR5A1
SCHEMBL7944853 0.80 TNFRSF1A (0.45) KMT2AKDM4EALDH1A1TSHR
SCHEMBL7943067 0.79 NR1H4 (0.48) KMT2AKDM4EALDH1A1HSD17B10TSHR
SCHEMBL8434295 0.78 RXRA (0.37) RXRAPPARGRARGALDH1A1TSHR
SCHEMBL2772372 0.77 RXRA (0.56) RXRAPPARGRARGNR5A2NR5A1
SCHEMBL5665923 0.77 RXRA (0.56) RXRAPPARGRARGNR5A2NR5A1

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-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
US-5891939-A POLYMER STABILIZERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-04-06 US disclosed