SCHEMBL27242532

SCHEMBL27242532

NS(=O)(=O)c1cccc(NC(=O)c2c3ccccc3nn2CC2CCCO2)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SCN10A Q9Y5Y9 3/20 0.45
ALDH1A1 P00352 4/20 0.45
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA9 Q16790 3/20 0.45
KDM4E B2RXH2 1/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NPC1 O15118 1/20 0.43
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
ATM Q13315 2/20 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
SCHEMBL30895722 1.00 MAPT (0.46) MAPTMAPK1SMN1; SMN2SCN10AALDH1A1
SCHEMBL27242534 0.97 SCN10A (0.45) MAPTMAPK1SMN1; SMN2SCN10AALDH1A1
SCHEMBL27242543 0.88 KMT2A (0.45) MAPTMAPK1SMN1; SMN2SCN10AALDH1A1
SCHEMBL27242530 0.87 PTGER4 (0.51) MAPTSCN10AALDH1A1CA12CA1
SCHEMBL27242598 0.86 SCN10A (0.50) MAPTSCN10AALDH1A1CA12CA1
SCHEMBL27242579 0.86 PTGER4 (0.55) MAPTSCN10AALDH1A1CA12CA1
SCHEMBL30895687 0.86 SCN10A (0.45) MAPTMAPK1SMN1; SMN2SCN10AALDH1A1
SCHEMBL27242469 0.86 SCN10A (0.44) MAPTMAPK1SMN1; SMN2SCN10AALDH1A1
SCHEMBL27242584 0.84 ROCK1 (0.49) MAPTSCN10AALDH1A1CA12CA1
SCHEMBL30895680 0.83 SCN10A (0.41) MAPTSCN10AALDH1A1KDM4EKMT2A

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
EP-4385980-A1 INDAZOLES AS INHIBITORS OF NAV1.8 Grünenthal GmbH (DE) 2024-06-19 EP disclosed