SCHEMBL8096523

SCHEMBL8096523

CN(C)c1nc(=O)n(-c2cc(NS(=O)(=O)CCl)c(Cl)cc2F)c(=O)n1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPOX P50336 1/20 0.33
MAPT P10636 1/20 0.31
BRD4 O60885 1/20 0.31

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
SCHEMBL8550866 0.78 BRD9 (0.39) PPOXMAPTBRD4
SCHEMBL8925114 0.78 BRD9 (0.30)
SCHEMBL8924769 0.73 PGK1 (0.36) PPOX
SCHEMBL11850116 0.72 HCAR1 (0.39)
SCHEMBL8922549 0.71 RHEB (0.42) PPOX
SCHEMBL11853044 0.69 MAT2A (0.44) MAPT
SCHEMBL7833797 0.69 PSIP1 (0.33) PPOXMAPTBRD4
SCHEMBL11850651 0.69 BRD9 (0.50) MAPT
SCHEMBL11837529 0.69 HCAR1 (0.38)
SCHEMBL7918650 0.68 PPOX (0.44) PPOXMAPTBRD4

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
US-6060432-A SYNERGISTIC MIXTURE; CROPS, AGRICULTURE E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-09 US disclosed