SCHEMBL8562649

SCHEMBL8562649

Cc1c(C(F)F)n(C)c(=O)n(-c2cc(NS(C)(=O)=O)c(Cl)cc2F)c1=O

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPOX P50336 1/20 0.45
MAPT P10636 2/20 0.34
TP53 P04637 2/20 0.32
TSHR P16473 1/20 0.32
BRD4 O60885 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7918650 0.79 PPOX (0.44) PPOXMAPTTP53TSHRBRD4
SCHEMBL8523910 0.75 PPOX (0.42) PPOXMAPTTP53TSHRBRD4
SCHEMBL5361878 0.74 PPOX (0.40) PPOXMAPTTP53BRD4GAA
SCHEMBL9081076 0.72 PPOX (0.42) PPOXMAPTTP53BRD4
SCHEMBL9710609 0.70 PPOX (0.50) PPOX
SCHEMBL10414302 0.69 PPOX (0.46) PPOXMAPTTP53BRD4
SCHEMBL8853738 0.68 BCAT2 (0.33) BRD4
SCHEMBL7893225 0.68 BRD4 (0.30) BRD4
SCHEMBL7218853 0.68 PPOX (0.49) PPOXMAPTTP53TSHRBRD4
SCHEMBL8096523 0.67 PPOX (0.33) 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
EP-0835247-A1 SUBSTITUTED CARBONYLAMINOPHENYLURACILS BAYER AG (DE) 1998-04-15 EP disclosed