SCHEMBL18923009

SCHEMBL18923009

O=C1CCC(CCCOC(=O)C(F)(F)S(=O)(=O)O)CC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 14/20 0.34
ASAH1 Q13510 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX1 P07099 1/20 0.31
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL4407802 0.85 EPHX1 (0.43) NAAAASAH1SMN1; SMN2EPHX1
SCHEMBL18923008 0.84 ALDH1A1 (0.32) ALDH1A1L3MBTL1
SCHEMBL4404941 0.84 EPHX1 (0.46) NAAAASAH1SMN1; SMN2EPHX1
SCHEMBL2605882 0.80 EPHX1 (0.51) NAAAASAH1SMN1; SMN2EPHX1
SCHEMBL13343903 0.79 ALDH1A1 (0.31) ALDH1A1L3MBTL1
SCHEMBL10312494 0.78 SMN1; SMN2 (0.33) NAAASMN1; SMN2EPHX1
SCHEMBL4404935 0.75 EPHX1 (0.38) NAAAASAH1SMN1; SMN2EPHX1ALDH1A1
SCHEMBL9998328 0.74 ALDH1A1 (0.42) NAAASMN1; SMN2EPHX1ALDH1A1
SCHEMBL13425199 0.74 EPHX1 (0.34) NAAAASAH1SMN1; SMN2EPHX1
SCHEMBL6398963 0.73 ALDH1A1 (0.35) ALDH1A1L3MBTL1

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
US-9671693-B2 Resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-06 US disclosed