SCHEMBL28634811

SCHEMBL28634811

Cc1cccc(C(=O)O)c1N1C(=O)CSC1c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 14/20 0.60
ALDH1A1 P00352 1/20 0.49
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46

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
SCHEMBL28625742 0.90 HTR7 (0.58) HTR7
SCHEMBL19330109 0.89 HTR7 (0.73) HTR7
SCHEMBL28629779 0.87 HTR7 (0.61) HTR7
SCHEMBL28629830 0.86 HTR7 (0.60) HTR7ALDH1A1CA1CA2CA9
SCHEMBL28631039 0.86 PTGS2 (0.61) HTR7CA1CA2CA9
SCHEMBL28645399 0.81 HTR7 (0.71) HTR7
SCHEMBL19330105 0.79 HTR7 (0.71) HTR7
SCHEMBL28636511 0.76 HTR7 (0.61) HTR7
SCHEMBL28641312 0.76 HTR7 (0.64) HTR7
SCHEMBL28636466 0.75 HTR7 (0.66) HTR7

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
CN-108883099-B Thiazolidinone compounds and use thereof 石全 2021-09-28 CN disclosed