SCHEMBL7867889

SCHEMBL7867889

COCCNC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2cccc(C(=O)NCc3ccccc3)c2)cn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.51
RAB9A P51151 2/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
HSD17B10 Q99714 1/20 0.49
EPHX2 P34913 2/20 0.46
POLB P06746 2/20 0.46
HDAC8 Q9BY41 3/20 0.44
HDAC6 Q9UBN7 3/20 0.44
HDAC2 Q92769 2/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPK1 P28482 1/20 0.43
P4HTM Q9NXG6 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42

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
SCHEMBL7869173 0.92 RAB9A (0.44) HTTRAB9AALDH1A1LMNAMAPK1
SCHEMBL7871636 0.92 RAB9A (0.46) HTTRAB9AALDH1A1EPHX2POLB
SCHEMBL7871628 0.91 HTT (0.53) HTTRAB9AALDH1A1GAAHSD17B10
SCHEMBL7871663 0.91 EPHX2 (0.49) ALDH1A1EPHX2LMNAL3MBTL1P4HTM
SCHEMBL7871660 0.90 SMN1; SMN2 (0.42) HTTRAB9APOLBLMNAP4HTM
SCHEMBL7862676 0.89 RAB9A (0.46) RAB9AALDH1A1POLBHDAC8HDAC6
SCHEMBL7862681 0.89 HSD17B10 (0.43) HTTRAB9AHSD17B10LMNAP4HTM
SCHEMBL7862689 0.89 RAB9A (0.43) HTTRAB9AALDH1A1LMNAP4HTM
SCHEMBL9018296 0.89 HTT (0.55) HTTRAB9AALDH1A1GAAHSD17B10
SCHEMBL7871609 0.87 P4HTM (0.55) MAPK1P4HTM

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-0562512-B1 Sulfonamidocarbonylpyridine-2-carboxamides and their use as medicines HOECHST AG (DE) 2001-02-21 EP disclosed
EP-0562512-A1 Sulfonamido- and sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1993-09-29 EP disclosed