SCHEMBL6422713

SCHEMBL6422713

CCOCC(OCC)C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
ALDH1A1 P00352 3/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ZDHHC7 Q9NXF8 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.30
SOAT1 P35610 1/20 0.30

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
SCHEMBL27974509 0.85 ALDH1A1 (0.39) TSHRMGAMGAASIMGAM2
SCHEMBL12072072 0.80 CA1 (0.42) TSHRMGAMGAASIMGAM2
SCHEMBL27829045 0.80 ALDH1A1 (0.41) TSHRMGAMGAASIMGAM2
SCHEMBL8903595 0.78 PPARA (0.41) TSHRALDH1A1
SCHEMBL28052418 0.78 ALDH1A1 (0.37) TSHRALDH1A1LMNAHSD17B10THRB
SCHEMBL19408671 0.78 PPARA (0.41) TSHRALDH1A1
SCHEMBL5793752 0.77 CA1 (0.44) TSHRMGAMGAASIMGAM2
SCHEMBL27314713 0.77 MGAM (0.36) TSHRMGAMGAASIMGAM2
Potassium Ion SCHEMBL28599223 0.75 PPARA (0.33) TSHRALDH1A1
SCHEMBL10012251 0.75 MGAM (0.39) TSHRMGAMGAASIMGAM2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050153205-A1 Carbon-covered lithium transition metal oxide, secondary cell positive electrode material and secondary cell MIKUNI SHIKISO KABUSHIKI KAISHA (JP) 2005-07-14 US disclosed
CN-1156041-C Method of manufacturing secondary battery negative electrode 花王株式会社 2004-06-30 CN disclosed
CN-1272227-A Method of manufacturing secondary battery negative electrode KAO CORP (JP) 2000-11-01 CN disclosed