SCHEMBL9517352

SCHEMBL9517352

CCOc1ccc(C(=O)NCCc2ccc(S(=O)(=O)NC(=O)c3ccc(COC(=O)c4ccccc4C)nc3)cc2)cc1OCC

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TSHR P16473 1/20 0.43
KMT2A Q03164 2/20 0.42
CNR2 P34972 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL9517201 0.93 TSHR (0.52) ALDH1A1TSHRCNR2CYSLTR1
SCHEMBL9515903 0.86 NPC1 (0.51) LMNASMN1; SMN2ALDH1A1KMT2ACYSLTR1
SCHEMBL9519208 0.85 P4HTM (0.39) LMNAALDH1A1KMT2ACYSLTR1
SCHEMBL9516791 0.84 LMNA (0.54) LMNASMN1; SMN2ALDH1A1TDP1NPSR1
SCHEMBL9516933 0.83 CNR2 (0.51) LMNASMN1; SMN2ALDH1A1TDP1NPSR1
SCHEMBL9515556 0.83 CNR2 (0.51) LMNASMN1; SMN2ALDH1A1TDP1NPSR1
SCHEMBL9515933 0.81 P4HTM (0.55) ALDH1A1TSHRKMT2A
SCHEMBL9517969 0.80 EPHX2 (0.44) LMNASMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL8868704 0.77 P4HTM (0.48) LMNASMN1; SMN2ALDH1A1TSHRKMT2A
SCHEMBL9516064 0.77 TSHR (0.62) ALDH1A1TSHRKMT2ACNR2CYSLTR1

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
EP-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed