SCHEMBL8317878

SCHEMBL8317878

Cc1ccc(S(=O)(=O)c2cc(OC(F)(F)F)ccc2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.50
ACHE P22303 1/20 0.50
FFAR4 Q5NUL3 3/20 0.46
CFTR P13569 1/20 0.43
CNR1 P21554 1/20 0.42
TP53 P04637 1/20 0.42
LIPE Q05469 1/20 0.42
NPY5R Q15761 1/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 2/20 0.41
GPR3 P46089 1/20 0.40
CES1 P23141 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL10985952 0.83 BCHE (0.50) BCHEACHEFFAR4CNR1TP53
SCHEMBL10988447 0.80 BCHE (0.66) BCHEACHEFFAR4TP53LIPE
SCHEMBL20773327 0.77 PTGES2 (0.47) FFAR4TP53SMN1; SMN2GAAGPR3
SCHEMBL20773580 0.76 CTDSP1 (0.46) FFAR4CFTRTP53KMT2ASMN1; SMN2
SCHEMBL23084377 0.76 GPR3 (0.41) FFAR4TP53SMN1; SMN2GAAGPR3
SCHEMBL3653050 0.76 GAA (0.52) MAPTKMT2AMEN1GAATDP1
SCHEMBL17774540 0.73 GAA (0.50) MAPTKMT2AMEN1HTTGAA
SCHEMBL28016377 0.73 HTT (0.43) BCHEACHEFFAR4CNR1TP53
SCHEMBL28952666 0.71 ALDH1A1 (0.53) BCHEACHEFFAR4TP53LIPE
SCHEMBL10976631 0.71 HSD11B1 (0.58) BCHEACHEFFAR4CNR1HTT

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-0966473-A1 THIAZOLOBENZOHETEROCYCLES, PREPARATION AND MEDICINES CONTAINING SAME Aventis Pharma S.A. (FR) 1999-12-29 EP disclosed
WO-1998038194-A1 THIAZOLOBENZOHETEROCYCLES, PREPARATION AND MEDICINES CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1998-09-03 WO disclosed