SCHEMBL8071992

SCHEMBL8071992

NS(=O)(=O)c1ccc(-c2csc(=O)n2-c2ccc(F)c(Cl)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 15/20 0.51
PTGS1 P23219 14/20 0.51
CA2 P00918 3/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA9 Q16790 2/20 0.47
SOS1 Q07889 2/20 0.45
PDPK1 O15530 1/20 0.42

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
SCHEMBL8061294 0.85 PTGS2 (0.52) PTGS2PTGS1CA2CA12CA1
SCHEMBL8071781 0.84 PTGS2 (0.48) PTGS2PTGS1CA2CA12CA1
SCHEMBL6729582 0.80 PTGS2 (0.44) PTGS2PTGS1CA2CA12CA1
SCHEMBL6737317 0.79 PTGS2 (0.43) PTGS2PTGS1CA2CA12CA1
SCHEMBL7215571 0.79 PTGS2 (0.62) PTGS2PTGS1SOS1
SCHEMBL8061374 0.78 PTGS2 (0.61) PTGS2PTGS1CA2CA12CA1
SCHEMBL8071998 0.77 CA12 (0.63) PTGS2PTGS1CA2CA12CA1
SCHEMBL6721959 0.77 PTGS2 (0.41) PTGS2PTGS1
SCHEMBL6726544 0.77 PTGS2 (0.42) PTGS2PTGS1CA2CA12CA1
SCHEMBL8061447 0.77 PTGS2 (0.62) PTGS2PTGS1CA2CA12CA1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1023277-A1 NOVEL 3,4-DIARYLTHIAZOLIN-2-ONE OR -2-THIONE DERIVATIVES, PREPARATION METHODS AND USES IN THERAPY LABORATOIRES UPSA (FR) 2000-08-02 EP claimed
WO-1999018093-A1 NOVEL 3,4-DIARYLTHIAZOLIN-2-ONE OR -2-THIONE DERIVATIVES, PREPARATION METHODS AND USES IN THERAPY LABORATOIRES UPSA (FR) 1999-04-15 WO claimed
EP-1023277-A1 NOVEL 3,4-DIARYLTHIAZOLIN-2-ONE OR -2-THIONE DERIVATIVES, PREPARATION METHODS AND USES IN THERAPY LABORATOIRES UPSA (FR) 2000-08-02 EP disclosed
WO-1999018093-A1 NOVEL 3,4-DIARYLTHIAZOLIN-2-ONE OR -2-THIONE DERIVATIVES, PREPARATION METHODS AND USES IN THERAPY LABORATOIRES UPSA (FR) 1999-04-15 WO disclosed