SCHEMBL818754

SCHEMBL818754

COC(=O)C1=CC=CCCC1C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 1/20 0.38
KCNH2 Q12809 1/20 0.38
ALDH1A1 P00352 9/20 0.35
KDM4E B2RXH2 4/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 3/20 0.33
ATM Q13315 2/20 0.33
GAA P10253 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
CHRM3 P20309 2/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
THRB P10828 1/20 0.32
CHRM1 P11229 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL13671086 0.83 KCNH2 (0.40) TSHRLMNASMN1; SMN2TP53KCNH2
SCHEMBL819762 0.77 ALDH1A1 (0.39) TSHRLMNAALDH1A1KDM4EHPGD
SCHEMBL819492 0.77 ALDH1A1 (0.34) TSHRLMNASMN1; SMN2TP53ALDH1A1
SCHEMBL818058 0.75 ALDH1A1 (0.37) TSHRLMNASMN1; SMN2TP53ALDH1A1
SCHEMBL31174918 0.75 KCNH2 (0.41) TSHRLMNASMN1; SMN2TP53KCNH2
SCHEMBL818207 0.74 KCNH2 (0.38) TSHRLMNASMN1; SMN2TP53KCNH2
SCHEMBL818458 0.74 KCNH2 (0.38) TSHRLMNASMN1; SMN2TP53KCNH2
SCHEMBL818660 0.74 ALDH1A1 (0.39) TSHRSMN1; SMN2TP53ALDH1A1HSD17B10
SCHEMBL819759 0.73 KCNH2 (0.34) TSHRKCNH2ALDH1A1KDM4EHPGD
SCHEMBL819627 0.73 TSHR (0.42) TSHRLMNATP53ALDH1A1KDM4E

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