SCHEMBL28630634

SCHEMBL28630634

Cc1cc(N2C(=O)CSC2c2ccc(C(F)(F)F)cc2)ccc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 18/20 0.55
KMT2A Q03164 1/20 0.46
GFER P55789 1/20 0.45

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
SCHEMBL28626024 0.89 HTR7 (0.69) HTR7KMT2AGFER
SCHEMBL30876411 0.81 HTR7 (0.80) HTR7
SCHEMBL19306174 0.81 HTR7 (0.80) HTR7
SCHEMBL19305961 0.77 HTR7 (0.68) HTR7KMT2AGFER
SCHEMBL28638514 0.75 HTR7 (0.67) HTR7KMT2AGFER
SCHEMBL19306136 0.74 HTR7 (0.80) HTR7
SCHEMBL28491691 0.73 HTR7 (0.58) HTR7KMT2AGFER
SCHEMBL28491694 0.73 HTR7 (0.58) HTR7KMT2AGFER
SCHEMBL4743953 0.72 GFER (0.60) HTR7KMT2AGFER
SCHEMBL8103220 0.72 GFER (0.63) HTR7KMT2AGFER

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