SCHEMBL28069903

SCHEMBL28069903

N#Cc1cc(F)ccc1S(=O)(=O)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 20/20 0.44
VEGFA P15692 3/20 0.42

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
SCHEMBL26598944 0.79 CA12 (0.46) EPAS1VEGFA
SCHEMBL29212553 0.79 EPAS1 (0.44) EPAS1
SCHEMBL29948948 0.79 TRPV4 (0.46) EPAS1
SCHEMBL16080223 0.79 TRPV4 (0.46) EPAS1
SCHEMBL30192879 0.77 ALDH1A1 (0.53)
SCHEMBL16555420 0.77 ALDH1A1 (0.53)
SCHEMBL12105498 0.73 NOTUM (0.43) EPAS1
SCHEMBL31287805 0.71 CA2 (0.41) EPAS1
SCHEMBL15545328 0.71 ALDH1A1 (0.41) EPAS1VEGFA
SCHEMBL28069808 0.70 EPAS1 (0.43) EPAS1VEGFA

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
CN-105530923-A Aryl ethers and their use PELOTON THERAPEUTICS INC 2016-04-27 CN disclosed