SCHEMBL819762

SCHEMBL819762

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
GAA P10253 5/20 0.39
KMT2A Q03164 4/20 0.39
KDM4E B2RXH2 4/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 3/20 0.39
HSD17B10 Q99714 3/20 0.39
HPGD P15428 2/20 0.39
TLR4 O00206 1/20 0.36
USP2 O75604 1/20 0.36
ALOX15 P16050 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HTT P42858 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 3/20 0.35
TSHR P16473 1/20 0.34
DHFR P00374 2/20 0.34
RAB9A P51151 1/20 0.34
ADORA2B P29275 1/20 0.34
POLB P06746 1/20 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
SCHEMBL818058 0.86 ALDH1A1 (0.37) ALDH1A1HSD17B10HPGDTDP1LMNA
SCHEMBL818752 0.83 TSHR (0.40) ALDH1A1KDM4EMAPTHPGDTDP1
SCHEMBL819627 0.83 TSHR (0.42) ALDH1A1KDM4EMAPTHSD17B10LMNA
SCHEMBL819131 0.82 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTHSD17B10LMNA
SCHEMBL818660 0.82 ALDH1A1 (0.39) ALDH1A1GAAMAPTHSD17B10HTT
SCHEMBL28369299 0.81 MAPT (0.43) ALDH1A1GAAKMT2AKDM4EMAPT
SCHEMBL819433 0.78 GAA (0.40) ALDH1A1GAAKMT2AKDM4EMAPT
SCHEMBL818754 0.77 TSHR (0.38) ALDH1A1GAAKDM4EMAPTHSD17B10
SCHEMBL819340 0.77 TLR4 (0.39) ALDH1A1GAAKMT2AKDM4EMAPT
SCHEMBL10632667 0.76 MAPT (0.44) ALDH1A1GAAKMT2AKDM4EMAPT

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