SCHEMBL7678752

SCHEMBL7678752

NS(=O)(=O)n1cnc2ncccc21

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MET P08581 6/20 0.37
FTO Q9C0B1 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MAPK1 P28482 1/20 0.35
CA9 Q16790 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LTA4H P09960 1/20 0.34
ALDH3A1 P30838 3/20 0.33
HTT P42858 2/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
NOD1 Q9Y239 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33

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
SCHEMBL5016823 0.78 KDM4E (0.49) METMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL830432 0.74 ALDH3A1 (0.57) MEN1KMT2AALDH3A1HTTGAA
SCHEMBL19791848 0.71 MET (0.64) METRAPGEF4
SCHEMBL21295269 0.71 LTA4H (0.38) MEN1MAPTKMT2ASMN1; SMN2LTA4H
SCHEMBL7165820 0.70 HTT (0.43) METMAPK1MEN1MAPTKMT2A
SCHEMBL31229913 0.69 LTA4H (0.39) MEN1MAPTKMT2ASMN1; SMN2LTA4H
SCHEMBL5571659 0.68 PARP1 (0.47) METMEN1KMT2ALTA4H
SCHEMBL1165560 0.67 LTA4H (0.38) KMT2ALTA4HPOLB
SCHEMBL13296647 0.67 LTA4H (0.38) KMT2ALTA4HPOLB
SCHEMBL256361 0.67 LTA4H (0.41) MEN1MAPTKMT2ALTA4HHTT

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-1250337-A1 SUBSTITUTED HOMOPIPERIDINYL BENZIMIDAZOLE ANALOGUES AS FUNDIC RELAXANTS Janssen Pharmaceutica N.V. (BE) 2002-10-23 EP disclosed
WO-2001046189-A1 SUBSTITUTED HOMOPIPERIDINYL BENZIMIDAZOLE ANALOGUES AS FUNDIC RELAXANTS JANSSEN PHARMACEUTICA N.V. (BE) 2001-06-28 WO disclosed