SCHEMBL819340

SCHEMBL819340

CCOC(=O)C1=CC(C)=CCCC1C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 0.39
GAA P10253 5/20 0.39
MAPT P10636 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RECQL P46063 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34

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
SCHEMBL28369299 0.88 MAPT (0.43) TLR4GAAMAPTMEN1KMT2A
SCHEMBL819729 0.85 L3MBTL1 (0.40) KDM4EALDH1A1HSD17B10HPGDLMNA
SCHEMBL818445 0.84 TSHR (0.40) MAPTALDH1A1HSD17B10HPGDLMNA
SCHEMBL818658 0.83 ALDH1A1 (0.38) GAAMAPTALDH1A1HSD17B10HTT
SCHEMBL819482 0.83 ALDH1A1 (0.42) MAPTKDM4EALDH1A1HSD17B10LMNA
SCHEMBL818458 0.80 KCNH2 (0.38) GAAMAPTKDM4EALDH1A1HSD17B10
SCHEMBL10632667 0.79 MAPT (0.44) TLR4GAAMAPTMEN1KMT2A
SCHEMBL819443 0.78 ALDH1A1 (0.47) MEN1KMT2AALDH1A1HSD17B10RECQL
SCHEMBL17036679 0.77 MEN1 (0.42) TLR4GAAMAPTMEN1KMT2A
SCHEMBL819762 0.77 ALDH1A1 (0.39) TLR4GAAMAPTMEN1KMT2A

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