SCHEMBL819397

SCHEMBL819397

COC(=O)C1=CCCC(C)C=C1C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.35
LMNA P02545 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
THRB P10828 1/20 0.34
CHRM1 P11229 1/20 0.34
KCNH2 Q12809 1/20 0.34
BLM P54132 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.32
NUAK1 O60285 1/20 0.32
IGF1R P08069 1/20 0.32
MET P08581 1/20 0.32
PIM1 P11309 1/20 0.32
SRC P12931 1/20 0.32
AXL P30530 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
SCHEMBL817065 0.81 LMNA (0.38) LMNATSHRTP53NPC1RAB9A
SCHEMBL817062 0.81 ALDH1A1 (0.37) LMNAHSD17B10TSHRKDM4EALDH1A1
SCHEMBL818362 0.79 ALDH1A1 (0.40) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL818821 0.79 TSHR (0.35) CHRM3LMNAHSD17B10TSHRPTPN1
SCHEMBL10937960 0.78 CHRM3 (0.45) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL818063 0.78 ALDH1A1 (0.41) CHRM3CHRM2CHRM4CHRM5CHRM1
SCHEMBL818810 0.77 TSHR (0.43) LMNAHSD17B10TSHRSMN1; SMN2TP53
SCHEMBL460975 0.76 SLC6A3 (0.32) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL16771923 0.75 ALDH1A1 (0.33) KCNH2HSD17B10TSHRSMN1; SMN2NPC1
SCHEMBL818234 0.75 ALDH1A1 (0.46) LMNAHSD17B10TSHRTP53NPC1

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