SCHEMBL7862728

SCHEMBL7862728

CC(=O)OCCNC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(CCNC(=O)C(C)C)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
EGFR P00533 2/20 0.39
EPHX2 P34913 2/20 0.37
P4HTM Q9NXG6 2/20 0.37
CA2 P00918 3/20 0.37
CA5A P35218 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
GFER P55789 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7867901 0.94 EGFR (0.39) MEN1KMT2ACACNA1BAPBA1EGFR
SCHEMBL7862691 0.92 MEN1 (0.41) MEN1KMT2AEGFREPHX2P4HTM
SCHEMBL7862837 0.91 POLB (0.43) MEN1KMT2ACACNA1BAPBA1EGFR
SCHEMBL7862835 0.90 EGFR (0.41) MEN1KMT2ACACNA1BAPBA1EGFR
SCHEMBL7869440 0.88 MEN1 (0.45) MEN1KMT2ACACNA1BAPBA1P4HTM
SCHEMBL8868540 0.88 P4HTM (0.44) MEN1KMT2ACACNA1BAPBA1EGFR
SCHEMBL9574710 0.87 EGFR (0.49) MEN1KMT2ACACNA1BAPBA1EGFR
SCHEMBL7862714 0.87 ALDH1A1 (0.45) MEN1KMT2ACACNA1BAPBA1EGFR
SCHEMBL7870590 0.87 MAPT (0.49) MEN1KMT2ACACNA1BAPBA1EPHX2
SCHEMBL9574656 0.86 MAPT (0.47) MEN1KMT2ACACNA1BAPBA1CA2

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