SCHEMBL27242534

SCHEMBL27242534

NS(=O)(=O)c1cccc(NC(=O)c2c3ccccc3nn2CC2CCCCO2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 4/20 0.45
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA9 Q16790 3/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
PTGER4 P35408 2/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.42
NPC1 O15118 1/20 0.42
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
RECQL P46063 1/20 0.41
MCL1 Q07820 1/20 0.41

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
SCHEMBL27242532 0.97 MAPT (0.46) SCN10ACA12CA1CA2CA9
SCHEMBL30895722 0.97 MAPT (0.46) SCN10ACA12CA1CA2CA9
SCHEMBL27242543 0.90 KMT2A (0.45) SCN10ACA12CA1CA2CA9
SCHEMBL30895687 0.88 SCN10A (0.45) SCN10ACA12CA1CA2CA9
SCHEMBL27242469 0.88 SCN10A (0.44) SCN10ACA12CA1CA2CA9
SCHEMBL27242579 0.87 PTGER4 (0.55) SCN10ACA12CA1CA2CA9
SCHEMBL27242530 0.86 PTGER4 (0.51) SCN10ACA12CA1CA2CA9
SCHEMBL30895680 0.86 SCN10A (0.41) SCN10AMAPTALDH1A1KDM4EKMT2A
SCHEMBL27242598 0.85 SCN10A (0.50) SCN10ACA12CA1CA2CA9
SCHEMBL27242584 0.84 ROCK1 (0.49) SCN10ACA12CA1CA2CA9

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