SCHEMBL4867340

SCHEMBL4867340

COc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2N(C)c2ccccc2)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
ALDH1A1 P00352 4/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 2/20 0.49
F2 P00734 2/20 0.47
PKM P14618 1/20 0.46
TP53 P04637 1/20 0.46
MAPK1 P28482 1/20 0.45
TMPRSS6 Q8IU80 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL3246229 0.84 HCRTR2 (0.49) TSHRALDH1A1KMT2AMEN1NPSR1
SCHEMBL3256243 0.83 ALDH1A1 (0.63) TSHRALDH1A1KMT2AMEN1NPSR1
SCHEMBL3247471 0.81 TSHR (0.52) TSHRALDH1A1KMT2ANPSR1SMN1; SMN2
SCHEMBL3247678 0.80 TSHR (0.53) TSHRALDH1A1KMT2ANPSR1SMN1; SMN2
SCHEMBL3250762 0.80 MAPT (0.53) TSHRALDH1A1KMT2AMEN1NPSR1
SCHEMBL3252098 0.79 TSHR (0.49) TSHRALDH1A1KMT2ANPSR1SMN1; SMN2
SCHEMBL3247755 0.79 MAPK1 (0.59) TSHRALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL3253821 0.78 MAPK1 (0.50) TSHRALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL3253343 0.78 ALDH1A1 (0.49) TSHRALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL4863480 0.78 ALDH1A1 (0.53) TSHRALDH1A1KMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396958-B2 Sulphonamide derivatives, their preparation and their therapeutic application SANOFI AVENTIS (FR) 2008-07-08 US disclosed