SCHEMBL8360832

SCHEMBL8360832

CC(=O)Nc1ccc(S(=O)(=O)Nc2nc(-c3cc(C(F)(F)F)ccc3F)cs2)cc1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.64
KDM1A O60341 2/20 0.53
PHGDH O43175 3/20 0.51
MPL P40238 2/20 0.51
AKT1 P31749 1/20 0.48
IDO1 P14902 1/20 0.48
USP2 O75604 2/20 0.48
USP8 P40818 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
POLB P06746 1/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL727086 0.86 NPSR1 (0.59) KDM1AMPLUSP2USP8MEN1
SCHEMBL727095 0.84 KDM1A (0.59) KDM1AMPLUSP2USP8MEN1
SCHEMBL16798990 0.84 MEN1 (0.66) KDM1AMPLUSP2USP8MEN1
SCHEMBL8357471 0.83 MEN1 (0.63) MAPTKDM1AMPLMEN1KMT2A
SCHEMBL8355149 0.80 MEN1 (0.54) MAPTKDM1AMPLMEN1KMT2A
SCHEMBL8110979 0.79 KDM1A (0.61) MAPTKDM1AMPLUSP2USP8
SCHEMBL15689027 0.77 MAPT (0.70) MAPTKDM1APHGDHUSP2USP8
SCHEMBL15698846 0.74 PHGDH (0.63) MAPTKDM1APHGDHUSP2USP8
SCHEMBL2762864 0.74 MAPT (0.77) MAPTKDM1APHGDHMEN1KMT2A
SCHEMBL15496614 0.73 IDO1 (0.75) MAPTKDM1AIDO1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958910-A Use of N-(4-aryl-thiazol-2-yl)-sulfonamides HOFFMANN-LA ROCHE INC. (US) 1999-09-28 US disclosed
US-5877193-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS HOFFMANN-LA ROCHE INC. (US) 1999-03-02 US disclosed
EP-0819681-A2 N-(4-Aryl-thiazol-2-yl)-sulfonamides and their use F. HOFFMANN-LA ROCHE AG (CH) 1998-01-21 EP disclosed