SCHEMBL20159336

SCHEMBL20159336

Cn1nc(I)nc1Oc1cc(F)cc(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 19/20 0.37
PPARG P37231 1/20 0.33

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
SCHEMBL23504822 0.84 SMN1; SMN2 (0.32) PPARG
SCHEMBL20139332 0.83 EPAS1 (0.40) EPAS1
SCHEMBL20159311 0.77 SMN1; SMN2 (0.42)
SCHEMBL23504765 0.77 BTK (0.36) EPAS1
SCHEMBL20160067 0.76 EPAS1 (0.33) EPAS1
SCHEMBL20139093 0.74 EPAS1 (0.38) EPAS1
SCHEMBL20138718 0.71 SMN1; SMN2 (0.34)
SCHEMBL20143018 0.69 EPAS1 (0.37) EPAS1PPARG
SCHEMBL20138671 0.69 EPAS1 (0.36) EPAS1PPARG
SCHEMBL29623268 0.69 EPAS1 (0.39) EPAS1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3538516-B1 PHENOXYTRIAZOLES HOFFMANN LA ROCHE (CH) 2021-06-16 EP disclosed
WO-2018087018-A1 PHENOXYTRIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2018-05-17 WO disclosed