SCHEMBL819318

SCHEMBL819318

CC1=CCCC(C(=O)OC(C)C)C(C(=O)OC(C)C)=C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA7 P43166 3/20 0.32
CA9 Q16790 3/20 0.32
CA14 Q9ULX7 3/20 0.32
ADORA2B P29275 5/20 0.31
FUCA1 P04066 1/20 0.31
CHRNA1 P02708 1/20 0.31
CHRNG P07510 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
SCHEMBL818658 0.77 ALDH1A1 (0.38) ALDH1A1HSD17B10GAAMAPTADORA2B
SCHEMBL819492 0.75 ALDH1A1 (0.34) KDM4EALDH1A1USP2LMNAHSD17B10
SCHEMBL819174 0.72 KDM4E (0.37) KDM4EALDH1A1USP2LMNAHSD17B10
SCHEMBL819729 0.70 L3MBTL1 (0.40) KDM4EALDH1A1LMNAHSD17B10TDP1
SCHEMBL818445 0.69 TSHR (0.40) ALDH1A1LMNAHSD17B10MAPTL3MBTL1
SCHEMBL819482 0.69 ALDH1A1 (0.42) KDM4EALDH1A1LMNAHSD17B10MAPT
SCHEMBL819443 0.67 ALDH1A1 (0.47) ALDH1A1LMNAHSD17B10MEN1KMT2A
SCHEMBL817772 0.67 ALDH1A1 (0.34) KDM4EALDH1A1USP2LMNAHSD17B10
SCHEMBL11337461 0.66 CA12 (0.34) KDM4EALDH1A1USP2LMNAHSD17B10
SCHEMBL818092 0.63 ALDH1A1 (0.36) KDM4EALDH1A1USP2LMNAHSD17B10

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-8236908-B2 Components and catalysts for the polymerization of olefins SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-07 US disclosed
US-20110269927-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed