SCHEMBL8867726

SCHEMBL8867726

CCCOC(=O)CNC(=O)c1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCC)cc2)cn1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 6/20 0.48
EGFR P00533 2/20 0.44
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
MMP1 P03956 1/20 0.39
CA2 P00918 1/20 0.39
BCL2L1 Q07817 1/20 0.39
MCL1 Q07820 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL8868726 0.92 P4HTM (0.50) P4HTMEGFRPOLBTDP1KMT2A
SCHEMBL8868717 0.92 P4HTM (0.48) P4HTMEGFRPOLBTDP1MEN1
SCHEMBL8869147 0.92 P4HTM (0.46) P4HTMEGFRPOLBTDP1MEN1
SCHEMBL8869167 0.90 P4HTM (0.54) P4HTMEGFRMEN1KMT2AFLT1
SCHEMBL8869141 0.90 P4HTM (0.45) P4HTMEGFRPOLBTDP1MEN1
SCHEMBL8870231 0.90 CA2 (0.47) P4HTMEGFRPOLBTDP1MEN1
SCHEMBL8869158 0.89 P4HTM (0.49) P4HTMCA12CA9CA2
SCHEMBL8868602 0.88 NPC1 (0.51) P4HTMPOLBMEN1KMT2ACA9
SCHEMBL8868067 0.88 HPGD (0.44) P4HTMEGFRPOLBTDP1MEN1
SCHEMBL9137563 0.88 P4HTM (0.52) P4HTMEGFRFLT1FLT4KDR

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