SCHEMBL30856840

SCHEMBL30856840

NS(=O)(=O)c1cccc(Oc2cc(F)cc(Cl)c2)c1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 20/20 0.56
VEGFA P15692 2/20 0.56

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
SCHEMBL16555485 1.00 EPAS1 (0.56) EPAS1VEGFA
SCHEMBL18054928 0.81 EPAS1 (0.58) EPAS1VEGFA
SCHEMBL29449333 0.75 NPY1R (0.41)
SCHEMBL31497815 0.73 EPAS1 (0.47) EPAS1VEGFA
SCHEMBL16555371 0.71 EPAS1 (1.00) EPAS1VEGFA
SCHEMBL15740074 0.71 EPAS1 (0.62) EPAS1VEGFA
SCHEMBL16556058 0.70 EPAS1 (0.63) EPAS1VEGFA
SCHEMBL30856930 0.70 EPAS1 (0.63) EPAS1VEGFA
SCHEMBL517079 0.69 ALDH1A1 (0.45)
SCHEMBL28105323 0.69 KMT2A (0.43)

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-RE49948-E1 Aryl ethers and uses thereof PELOTON THERAPEUTICS, INC. (US) 2024-04-30 US disclosed