SCHEMBL28823355

SCHEMBL28823355

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

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
SCHEMBL29816452 1.00 DHODH (1.00) DHODH
SCHEMBL20107740 1.00 DHODH (1.00) DHODH
SCHEMBL21917870 0.95 DHODH (0.90) DHODH
SCHEMBL21853365 0.92 DHODH (1.00) DHODH
SCHEMBL21853364 0.92 DHODH (1.00) DHODH
SCHEMBL29815793 0.92 DHODH (1.00) DHODH
SCHEMBL20108132 0.89 DHODH (1.00) DHODH
SCHEMBL26686982 0.89 DHODH (1.00) DHODH
SCHEMBL29816577 0.89 DHODH (1.00) DHODH
SCHEMBL21853453 0.88 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115557907-A 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors 拜耳股份有限公司 2023-01-03 CN claimed
CN-115557907-A 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors 拜耳股份有限公司 2023-01-03 CN disclosed
CN-110023302-B 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors 拜耳股份有限公司 2022-07-26 CN disclosed