SCHEMBL3247544

SCHEMBL3247544

O=C(CNS(=O)(=O)c1ccccc1)Nc1ccc(Cl)cc1C(O)c1ccccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 3/20 0.48
HTT P42858 1/20 0.48
TSHR P16473 1/20 0.47
ERBB2 P04626 1/20 0.44
HSP90AA1 P07900 1/20 0.44
HSP90AB1 P08238 1/20 0.44
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEP1B Q16820 1/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
FLT1 P17948 1/20 0.40
FLT4 P35916 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
SCHEMBL3244695 0.94 CYP1A2 (0.48) ALDH1A1MAPTLMNAHTTTSHR
SCHEMBL3253240 0.91 ALDH1A1 (0.46) ALDH1A1MAPTLMNAHTTTSHR
SCHEMBL3246435 0.90 ALDH1A1 (0.42) ALDH1A1MAPTLMNAHTTTSHR
SCHEMBL3251363 0.89 SMN1; SMN2 (0.43) ALDH1A1MAPTLMNAHTTMEN1
SCHEMBL3251156 0.89 FLT1 (0.42) ALDH1A1MAPTLMNAHTTMEN1
SCHEMBL4869106 0.89 TSHR (0.47) ALDH1A1MAPTLMNATSHRERBB2
SCHEMBL3250956 0.89 CTSS (0.47) ALDH1A1MAPTLMNAHTTMEN1
SCHEMBL3249174 0.88 L3MBTL1 (0.44) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL3252376 0.88 MEP1B (0.53) ALDH1A1MAPTLMNAHTTTSHR
SCHEMBL3253080 0.86 FDFT1 (0.40) ALDH1A1MAPTLMNAMEN1POLB

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-1776347-B1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2010-05-26 EP disclosed
US-7396958-B2 Sulphonamide derivatives, their preparation and their therapeutic application SANOFI AVENTIS (FR) 2008-07-08 US disclosed