SCHEMBL20108044

SCHEMBL20108044

Cc1cccc(F)c1NC(=O)c1cc(F)c(-n2nc(C(C)O)n(C)c2=O)cc1OCC(F)(F)F

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.80

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
SCHEMBL20107925 0.92 DHODH (0.80) DHODH
SCHEMBL20107810 0.90 DHODH (0.80) DHODH
SCHEMBL20108043 0.89 DHODH (1.00) DHODH
SCHEMBL22713082 0.89 DHODH (1.00) DHODH
SCHEMBL29815878 0.89 DHODH (1.00) DHODH
SCHEMBL20107731 0.88 DHODH (0.82) DHODH
SCHEMBL20107679 0.87 DHODH (0.81) DHODH
SCHEMBL20107943 0.87 DHODH (0.79) DHODH
SCHEMBL20108182 0.87 DHODH (0.76) DHODH
SCHEMBL20108051 0.87 DHODH (0.78) 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