SCHEMBL27242530

SCHEMBL27242530

NS(=O)(=O)c1cccc(NC(=O)c2c3ccccc3nn2CC2CCC2)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.51
SCN10A Q9Y5Y9 3/20 0.48
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 1/20 0.46
ROCK2 O75116 1/20 0.45
ROCK1 Q13464 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL27242579 0.97 PTGER4 (0.55) PTGER4SCN10ACA1CA2CA12
SCHEMBL27242598 0.92 SCN10A (0.50) PTGER4SCN10ACA1CA2CA12
SCHEMBL27242430 0.91 PTGER4 (0.51) PTGER4KDM4EALDH1A1MAPTMEN1
SCHEMBL27242495 0.90 CA1 (0.45) PTGER4SCN10ACA1CA2CA12
SCHEMBL27242389 0.89 CA1 (0.47) PTGER4SCN10ACA1CA2CA12
SCHEMBL27242607 0.89 PTGER4 (0.53) PTGER4KDM4EALDH1A1MAPTMEN1
SCHEMBL27242584 0.88 ROCK1 (0.49) PTGER4SCN10ACA1CA2CA12
SCHEMBL30895722 0.87 MAPT (0.46) SCN10ACA1CA2CA12CA9
SCHEMBL27242532 0.87 MAPT (0.46) SCN10ACA1CA2CA12CA9
SCHEMBL27242534 0.86 SCN10A (0.45) PTGER4SCN10ACA1CA2CA12

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