SCHEMBL20110620

SCHEMBL20110620

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

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TSHR P16473 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
SCHEMBL20117645 0.80 ALDH1A1 (0.38) ALDH1A1
SCHEMBL10064116 0.73 TSHR (0.39) ALDH1A1TSHR
SCHEMBL26289127 0.72 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL27354323 0.71 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL13451534 0.70 TSHR (0.37) ALDH1A1TSHR
SCHEMBL13451525 0.70 THRB (0.42) ALDH1A1TSHR
SCHEMBL27822336 0.70 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL1401750 0.70 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL8400059 0.69 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL10949794 0.69 ALDH1A1 (0.41) ALDH1A1TSHR

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-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