SCHEMBL8768350

SCHEMBL8768350

CC(C)COc1cc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCc3ccc(F)cc3)cc2)cnc1OC(=O)NCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
BCL2L1 Q07817 1/20 0.40
MCL1 Q07820 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
TSHR P16473 1/20 0.38
TBXA2R P21731 1/20 0.37
TBXAS1 P24557 1/20 0.37
GFER P55789 1/20 0.37

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
SCHEMBL8768266 0.91 ROCK2 (0.46) MAPTBCL2L1MCL1MEN1KMT2A
SCHEMBL8917687 0.89 MAPT (0.45) MAPTBCL2L1MCL1MEN1KMT2A
SCHEMBL9235404 0.87 MAPT (0.46) MAPTBCL2L1MCL1MEN1KMT2A
SCHEMBL8768265 0.84 LMNA (0.44) MAPTMEN1KMT2ACA12CA1
SCHEMBL8767144 0.83 LMNA (0.38) PTGS2LMNASMN1; SMN2HTT
SCHEMBL8767453 0.83 LMNA (0.42) MAPTKMT2ANPSR1NPC1RAB9A
SCHEMBL8916374 0.81 ROCK2 (0.48) MAPTBCL2L1MCL1MEN1KMT2A
SCHEMBL8098569 0.81 MAPT (0.40) MAPTMEN1KMT2APTGS1PTGS2
SCHEMBL8105999 0.79 MAPT (0.47) MAPTBCL2L1MCL1MEN1KMT2A
SCHEMBL9195194 0.78 BCL2L1 (0.50) MAPTBCL2L1MCL1MEN1KMT2A

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-0673931-B1 Sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AG (DE) 1997-08-13 EP disclosed
EP-0673931-A1 Sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-27 EP disclosed