SCHEMBL20108007

SCHEMBL20108007

CCc1nn(-c2cc(OCC(F)(F)F)c(C(=O)Nc3c(F)cccc3F)cc2F)c(=O)n1C1CC1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.78

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
SCHEMBL20108230 0.95 DHODH (0.79) DHODH
SCHEMBL20107648 0.91 DHODH (0.78) DHODH
SCHEMBL20107614 0.90 DHODH (0.76) DHODH
SCHEMBL20108260 0.89 DHODH (0.76) DHODH
SCHEMBL20107936 0.88 DHODH (0.76) DHODH
SCHEMBL20108166 0.88 DHODH (0.78) DHODH
SCHEMBL20108008 0.88 DHODH (1.00) DHODH
SCHEMBL29493459 0.88 DHODH (1.00) DHODH
SCHEMBL20108237 0.87 DHODH (0.76) DHODH
SCHEMBL20108255 0.87 DHODH (0.77) DHODH

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-3532468-B1 2,4,5-TRISUBSTITUTED 1,2,4-TRIAZOLONES USEFUL AS INHIBITORS OF DHODH BAYER AG (DE) 2022-03-23 EP disclosed
WO-2018077923-A1 2,4,5-TRISUBSTITUTED 1,2,4-TRIAZOLONES USEFUL AS INHIBITORS OF DHODH BAYER AKTIENGESELLSCHAFT (DE) 2018-05-03 WO disclosed