SCHEMBL20107755

SCHEMBL20107755

Cc1nn(-c2cc(OCC(F)(F)F)c(C(=O)Nc3ccccc3F)cc2F)c(=O)n1C1CC1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.76

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
SCHEMBL20107614 0.91 DHODH (0.76) DHODH
SCHEMBL20107648 0.91 DHODH (0.78) DHODH
SCHEMBL20107871 0.89 DHODH (0.77) DHODH
SCHEMBL20108237 0.88 DHODH (0.76) DHODH
SCHEMBL20107754 0.86 DHODH (1.00) DHODH
SCHEMBL29815370 0.86 DHODH (1.00) DHODH
SCHEMBL26686970 0.86 DHODH (1.00) DHODH
SCHEMBL20108159 0.84 DHODH (0.54) DHODH
SCHEMBL28953394 0.84 DHODH (0.76) DHODH
SCHEMBL20108082 0.84 DHODH (0.76) 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