SCHEMBL20107695

SCHEMBL20107695

CC(Oc1cc(-n2nc(C(F)(F)F)n(C)c2=O)c(F)cc1C(=O)Nc1c(F)cccc1F)C(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 1.00

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
SCHEMBL20107687 1.00 DHODH (1.00) DHODH
SCHEMBL20108228 0.95 DHODH (1.00) DHODH
SCHEMBL20108227 0.95 DHODH (1.00) DHODH
SCHEMBL29815392 0.95 DHODH (1.00) DHODH
SCHEMBL20108242 0.95 DHODH (1.00) DHODH
SCHEMBL29815407 0.95 DHODH (1.00) DHODH
SCHEMBL29816481 0.94 DHODH (1.00) DHODH
SCHEMBL22713092 0.94 DHODH (1.00) DHODH
SCHEMBL20107787 0.94 DHODH (1.00) DHODH
SCHEMBL20107697 0.91 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