SCHEMBL7817166

SCHEMBL7817166

COC(=O)CC(=O)OCCCl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.44
GAA P10253 2/20 0.44
SI P14410 2/20 0.44
MGAM2 Q2M2H8 2/20 0.44
TSHR P16473 4/20 0.42
HSD17B10 Q99714 1/20 0.39
KMT2A Q03164 2/20 0.35
ADRA2A P08913 1/20 0.33
ADRA1A P35348 1/20 0.33
FAAH O00519 1/20 0.33
TP53 P04637 1/20 0.32
TET2 Q6N021 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
NAAA Q02083 1/20 0.31
CA12 O43570 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CYP2C19 P33261 1/20 0.31
DGKA P23743 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
SCHEMBL9064890 0.90 MGAM (0.46) MGAMGAASIMGAM2TSHR
SCHEMBL14375215 0.85 MGAM (0.52) MGAMGAASIMGAM2TSHR
SCHEMBL7815088 0.84 MGAM (0.48) MGAMGAASIMGAM2TSHR
SCHEMBL74272 0.81 GAA (0.50) MGAMGAASIMGAM2TSHR
Hydrochloric Acid SCHEMBL11876710 0.79 MGAM (0.43) MGAMGAASIMGAM2TSHR
SCHEMBL9064894 0.78 LDHA (0.38) MGAMGAASIMGAM2TSHR
SCHEMBL16368788 0.78 GAA (0.46) MGAMGAASIMGAM2TSHR
SCHEMBL240959 0.78 MGAM (0.52) MGAMGAASIMGAM2TSHR
SCHEMBL27852722 0.78 MGAM (0.46) MGAMGAASIMGAM2TSHR
Ethyl Chloride SCHEMBL27964985 0.76 MGAM (0.55) MGAMGAASIMGAM2TSHR

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
EP-1112268-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND HERBICIDES CONTAINING THEM SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2001-07-04 EP disclosed
WO-2000015633-A1 CONDENSED HETEROCYLIC COMPOUNDS AND HERBICIDES CONTAINING THEM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-03-23 WO disclosed