SCHEMBL818207

SCHEMBL818207

COC(=O)C1=CC=C(C)CCC1C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.38
ALDH1A1 P00352 7/20 0.36
KDM4E B2RXH2 5/20 0.36
HPGD P15428 2/20 0.36
ATM Q13315 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 6/20 0.36
PTPN1 P18031 1/20 0.35
HTT P42858 1/20 0.34
TSHR P16473 3/20 0.34
HSD17B10 Q99714 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
THRB P10828 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
SCHEMBL819433 0.78 GAA (0.40) ALDH1A1KDM4EHPGDMAPTHTT
SCHEMBL819174 0.77 KDM4E (0.37) ALDH1A1KDM4EMAPTHSD17B10LMNA
SCHEMBL818754 0.74 TSHR (0.38) KCNH2ALDH1A1KDM4EHPGDATM
SCHEMBL817269 0.74 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTHTTTSHR
SCHEMBL818110 0.73 L3MBTL1 (0.41) ALDH1A1KDM4EHPGDATMCYP1A2
SCHEMBL817755 0.73 TSHR (0.42) ALDH1A1HPGDATMMAPTTSHR
SCHEMBL817763 0.72 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTTSHRHSD17B10
SCHEMBL31174918 0.71 KCNH2 (0.41) KCNH2ALDH1A1KDM4EHPGDATM
SCHEMBL818458 0.71 KCNH2 (0.38) KCNH2ALDH1A1KDM4EHPGDATM
SCHEMBL13671086 0.70 KCNH2 (0.40) KCNH2ALDH1A1KDM4EHPGDATM

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