SCHEMBL818859

SCHEMBL818859

CCOC(=O)C1=C(C(=O)OCC)CC(C)CC=C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 3/20 0.39
ALOX15 P16050 2/20 0.39
MEN1 O00255 2/20 0.39
TSHR P16473 3/20 0.39
ALDH1A1 P00352 6/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.36
HSD17B10 Q99714 3/20 0.34
GAA P10253 4/20 0.34
HPGD P15428 2/20 0.34
MAPK1 P28482 1/20 0.34
ALOX12 P18054 1/20 0.34
CA12 O43570 4/20 0.33
CA1 P00915 4/20 0.33
CA2 P00918 4/20 0.33
CA7 P43166 4/20 0.33
CA9 Q16790 4/20 0.33
CA14 Q9ULX7 4/20 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
SCHEMBL818036 0.88 ALDH1A1 (0.41) KDM4ETSHRALDH1A1TDP1LMNA
SCHEMBL817155 0.86 TSHR (0.44) TSHRALDH1A1TDP1LMNAHSD17B10
SCHEMBL817762 0.85 TSHR (0.46) KDM4EMAPTTSHRALDH1A1TDP1
SCHEMBL817111 0.84 ALDH1A1 (0.47) KDM4EMAPTTSHRALDH1A1LMNA
SCHEMBL818541 0.80 NPSR1 (0.32) KDM4EMAPTTSHRALDH1A1TDP1
SCHEMBL818502 0.76 KDM4E (0.39) KDM4EKMT2AMAPTALOX15MEN1
SCHEMBL12808756 0.74 MEN1 (0.43) KDM4EKMT2AMAPTALOX15MEN1
SCHEMBL17787820 0.73 KDM4E (0.39) KDM4EKMT2AMAPTALOX15MEN1
SCHEMBL818824 0.72 KMT2A (0.41) KDM4EKMT2AMAPTALOX15MEN1
SCHEMBL819237 0.71 TSHR (0.50) KDM4EKMT2AMAPTALOX15MEN1

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