SCHEMBL10074407

SCHEMBL10074407

CC(C)(S)CC(=O)OCCCCOC(O)CC(C)(C)S

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL1756074 0.83 NAAA (0.43) NAAATDP1
SCHEMBL869221 0.75 DGKA (0.37) NAAATDP1
SCHEMBL23198173 0.74 NAAA (0.34) NAAA
SCHEMBL28150175 0.74 NAAA (0.38) NAAATDP1
SCHEMBL19433047 0.70 ALDH1A1 (0.35)
SCHEMBL27968609 0.66 GAA (0.50)
SCHEMBL869482 0.64 MAPK1 (0.32)
SCHEMBL4463477 0.63 NAAA (0.37) NAAA
SCHEMBL8374682 0.62 ALDH1A1 (0.38)
SCHEMBL28463776 0.62 NAAA (0.62) NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1983017-B1 CURABLE COMPOSITION CONTAINING THIOL COMPOUND SHOWA DENKO KK (JP) 2012-04-18 EP disclosed