SCHEMBL9670764

SCHEMBL9670764

CC(Nc1ccc(OC(F)(F)F)cc1)S(N)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.51
EPHX2 P34913 2/20 0.46
ALDH1A1 P00352 4/20 0.43
HPGD P15428 1/20 0.43
MAPT P10636 2/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 1/20 0.42
FFAR4 Q5NUL3 2/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.41
PDE2A O00408 1/20 0.41
CA7 P43166 1/20 0.41
POLB P06746 1/20 0.40
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL8359975 0.78 MAPT (0.52) KIF11EPHX2ALDH1A1HPGDMAPT
SCHEMBL5499496 0.75 EPHX2 (0.54) KIF11EPHX2ALDH1A1HPGDMAPT
SCHEMBL21339362 0.75 ALDH1A1 (0.49) KIF11EPHX2ALDH1A1HPGDMAPT
SCHEMBL7717477 0.73 EPHX2 (0.56) KIF11EPHX2ALDH1A1HPGDMAPT
SCHEMBL7717474 0.73 EPHX2 (0.56) KIF11EPHX2ALDH1A1HPGDMAPT
SCHEMBL6698062 0.72 TDP1 (0.52) ALDH1A1CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL7704859 0.72 EPHX2 (0.54) KIF11EPHX2ALDH1A1HPGDMAPT
Hydrochloric Acid SCHEMBL7704862 0.72 EPHX2 (0.54) KIF11EPHX2ALDH1A1HPGDMAPT
SCHEMBL11205128 0.71 ALDH1A1 (0.58) KIF11EPHX2ALDH1A1HPGDMAPT
SCHEMBL11205131 0.71 ALDH1A1 (0.58) KIF11EPHX2ALDH1A1HPGDMAPT

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
EP-0375510-B1 2-IMINO-6-POLYFLUOROALCOXY-BENZOTHIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM RHONE-POULENC SANTE (FR) 1992-11-11 EP disclosed
EP-0375510-A1 2-Imino-6-polyfluoroalcoxy-benzothiazole derivatives, process for their preparation and medicaments containing them RHONE-POULENC SANTE (FR) 1990-06-27 EP disclosed