SCHEMBL8930635

SCHEMBL8930635

COc1nc2cc(C)c(Cl)c(N(CCNS(=O)(=O)C(F)(F)F)S(C)(=O)=O)c2nc1OC

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.36
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 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
SCHEMBL8930645 0.89 GRIN1 (0.36) GRIN1MEN1HTTKMT2A
SCHEMBL8488354 0.81 GRIN1 (0.40) GRIN1MEN1KMT2A
SCHEMBL8488133 0.81 GRIN1 (0.39) GRIN1MEN1KMT2A
SCHEMBL8930335 0.80 GRIN1 (0.38) GRIN1
SCHEMBL8488434 0.80 GRIN1 (0.43) GRIN1MEN1KMT2A
SCHEMBL8488186 0.78 GRIN1 (0.39) GRIN1MEN1KMT2A
SCHEMBL8485125 0.78 ALDH1A1 (0.48) GRIN1MEN1KMT2A
SCHEMBL8488905 0.78 ALDH1A1 (0.38) GRIN1MEN1KMT2A
SCHEMBL8487638 0.74 GRIN1 (0.37) GRIN1MEN1HTTKMT2A
SCHEMBL7464603 0.72 GRIN1 (0.39) GRIN1MEN1KMT2A

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-0792874-A1 Quinoxaline derivatives useful in therapy Pfizer Limited (GB) 1997-09-03 EP disclosed