SCHEMBL28280396

SCHEMBL28280396

OCc1sccc1-c1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 11/20 0.59
MAPK14 Q16539 1/20 0.47
PTGS2 P35354 7/20 0.42
PRKCZ Q05513 1/20 0.38
MAPT P10636 1/20 0.35

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
SCHEMBL3718637 0.82 PTGS1 (0.49) PTGS1MAPK14PTGS2PRKCZ
SCHEMBL6920647 0.80 PTGS1 (0.39) PTGS1PRKCZMAPT
SCHEMBL16048484 0.80 NOTUM (0.40) PTGS1PTGS2PRKCZMAPT
SCHEMBL3988930 0.80 PTGS2 (0.44) PTGS1PTGS2MAPT
SCHEMBL5107107 0.79 BCAT2 (0.48) PTGS1PTGS2
SCHEMBL27691526 0.76 PTGS1 (0.53) PTGS1
SCHEMBL10843937 0.72 MAPK14 (0.79) PTGS1MAPK14PTGS2
SCHEMBL1475136 0.72
SCHEMBL7323658 0.71 MAPK14 (0.50) PTGS1MAPK14PTGS2
SCHEMBL695291 0.71 PTGS1 (0.51) PTGS1MAPK14PTGS2PRKCZ

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
CN-109336874-B Preparation method of canagliflozin 江苏工程职业技术学院 2022-03-11 CN disclosed
CN-109336874-A A kind of preparation method of canagliflozin 江苏工程职业技术学院 2019-02-15 CN disclosed