SCHEMBL20108002

SCHEMBL20108002

CC(Oc1cc(-n2nc(C(=O)O)n(CCl)c2=O)c(F)cc1C(=O)Nc1c(F)cccc1Cl)C(C)(F)F

nearest known ligand 0.90

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.90

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
SCHEMBL21853454 0.95 DHODH (1.00) DHODH
SCHEMBL29493461 0.95 DHODH (1.00) DHODH
SCHEMBL25909397 0.95 DHODH (1.00) DHODH
SCHEMBL29815353 0.90 DHODH (1.00) DHODH
SCHEMBL21853400 0.90 DHODH (1.00) DHODH
SCHEMBL20107998 0.90 DHODH (1.00) DHODH
SCHEMBL20108050 0.88 DHODH (1.00) DHODH
SCHEMBL21853401 0.88 DHODH (1.00) DHODH
SCHEMBL29815909 0.88 DHODH (1.00) DHODH
SCHEMBL21853368 0.87 DHODH (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018077923-A1 2,4,5-TRISUBSTITUTED 1,2,4-TRIAZOLONES USEFUL AS INHIBITORS OF DHODH BAYER AKTIENGESELLSCHAFT (DE) 2018-05-03 WO disclosed