SCHEMBL20117645

SCHEMBL20117645

C=C(C)C(=O)OC(C)(C)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL20110620 0.80 ALDH1A1 (0.41) ALDH1A1
SCHEMBL5872092 0.77 ALDH1A1 (0.35) ALDH1A1
SCHEMBL775729 0.77 TSHR (0.37) ALDH1A1CA1CA2MAPK1SMN1; SMN2
SCHEMBL15836504 0.76 ALDH1A1 (0.34) ALDH1A1CA1CA2MAPK1SMN1; SMN2
SCHEMBL13467163 0.73 TSHR (0.34) ALDH1A1
SCHEMBL13466318 0.73 THRB (0.39) ALDH1A1
SCHEMBL12000703 0.73 ALDH1A1 (0.46) ALDH1A1CA1CA2MAPK1SMN1; SMN2
SCHEMBL27405276 0.72 ALDH1A1 (0.38) ALDH1A1CA1CA2MAPK1SMN1; SMN2
SCHEMBL13451535 0.72 THRB (0.35) ALDH1A1
SCHEMBL13451530 0.71 TSHR (0.43) ALDH1A1

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-10241411-B2 Topcoat compositions containing fluorinated thermal acid generators ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2019-03-26 US disclosed
US-20180118968-A1 TOPCOAT COMPOSITIONS CONTAINING FLUORINATED THERMAL ACID GENERATORS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2018-05-03 US disclosed