SCHEMBL8868481

SCHEMBL8868481

COCCNC(=O)c1ccc(C(=O)NS(=O)(=O)c2ccc(NC(=O)Cc3ccccc3)cc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC4 P56524 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
P4HTM Q9NXG6 3/20 0.50
SCN3A Q9NY46 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 2/20 0.46
BCL2 P10415 1/20 0.46
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
PRMT1 Q99873 1/20 0.46
PKM P14618 1/20 0.46
KDM4E B2RXH2 1/20 0.45
BDKRB1 P46663 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CA12 O43570 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
SCHEMBL8868734 0.91 L3MBTL1 (0.55) HDAC1P4HTMLMNABCL2BCL2L1
SCHEMBL8868396 0.91 HDAC3 (0.54) HDAC3HDAC1HDAC8HDAC4HDAC6
SCHEMBL8870040 0.90 L3MBTL1 (0.48) HDAC3HDAC1HDAC8HDAC4HDAC6
SCHEMBL8869178 0.89 P4HTM (0.54) P4HTMNPC1RAB9ALMNAPKM
SCHEMBL8869871 0.89 P4HTM (0.49) P4HTMNPC1RAB9ALMNAKDM4E
SCHEMBL9143209 0.88 RAB9A (0.57) HDAC3HDAC1HDAC8HDAC4HDAC6
SCHEMBL8868506 0.88 P4HTM (0.51) P4HTMPKMKDM4EBDKRB1KMT2A
SCHEMBL7869467 0.87 MEN1 (0.48) P4HTMSCN3ANPC1RAB9ALMNA
SCHEMBL8868915 0.87 P4HTM (0.66) P4HTMCA12CA1CA2CA5A
SCHEMBL8870497 0.86 P4HTM (0.49) P4HTMLMNAPKMKDM4EMEN1

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-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed