SCHEMBL9518080

SCHEMBL9518080

CCCCNC(=O)c1cccc(S(=O)(=O)NC(=O)c2ccc(COCC)nc2)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
FBP1 P09467 1/20 0.44
CASP3 P42574 2/20 0.43
KMT2A Q03164 2/20 0.42
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
P4HTM Q9NXG6 3/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
KAT6A Q92794 1/20 0.41
MEN1 O00255 1/20 0.40
PTGDR Q13258 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL9516250 0.89 CA2 (0.46) SMN1; SMN2KMT2AP4HTMKDM4EALDH1A1
SCHEMBL9516171 0.85 SMN1; SMN2 (0.46) SMN1; SMN2FBP1CASP3KMT2AP4HTM
SCHEMBL9141271 0.83 SMN1; SMN2 (0.49) SMN1; SMN2FBP1KMT2ABCL2L1MCL1
SCHEMBL9138978 0.83 P4HTM (0.61) SMN1; SMN2FBP1CASP3KMT2ABCL2L1
SCHEMBL9517068 0.82 CASP3 (0.47) SMN1; SMN2CASP3KMT2AP4HTMMEN1
SCHEMBL8868877 0.82 SMN1; SMN2 (0.50) SMN1; SMN2FBP1KMT2ABCL2L1MCL1
SCHEMBL9515532 0.82 P4HTM (0.61) CASP3BCL2L1MCL1P4HTMKAT6A
SCHEMBL9018092 0.81 SMN1; SMN2 (0.47) SMN1; SMN2FBP1CASP3KMT2ABCL2L1
SCHEMBL8868132 0.81 SMN1; SMN2 (0.47) SMN1; SMN2FBP1KMT2ABCL2L1MCL1
SCHEMBL9142109 0.81 SMN1; SMN2 (0.47) SMN1; SMN2FBP1CASP3KMT2ABCL2L1

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