SCHEMBL20108017

SCHEMBL20108017

CCCCOc1cc(-n2nc(CO)n(C)c2=O)c(F)cc1C(=O)Nc1c(C)cccc1F

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
SCHEMBL20108158 0.95 DHODH (0.77) DHODH
SCHEMBL24282504 0.91 DHODH (0.78) DHODH
SCHEMBL20108051 0.89 DHODH (0.78) DHODH
SCHEMBL20108244 0.87 DHODH (0.80) DHODH
SCHEMBL20108016 0.87 DHODH (1.00) DHODH
SCHEMBL22713098 0.87 DHODH (1.00) DHODH
SCHEMBL20107851 0.87 DHODH (0.75) DHODH
SCHEMBL20107698 0.87 DHODH (0.78) DHODH
SCHEMBL20107775 0.86 DHODH (0.70) DHODH
SCHEMBL29815653 0.85 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 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