SCHEMBL28823364

SCHEMBL28823364

CCc1nn(-c2cc(OC(C)c3ccccc3)c(C(=O)NC(CC)CC#N)cc2F)c(=O)n1C

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
SCHEMBL20108261 1.00 DHODH (1.00) DHODH
SCHEMBL29815327 0.93 DHODH (1.00) DHODH
SCHEMBL20107782 0.93 DHODH (1.00) DHODH
SCHEMBL20108262 0.87 DHODH (0.77) DHODH
SCHEMBL28306373 0.86 DHODH (0.75) DHODH
SCHEMBL21853502 0.84 DHODH (0.79) DHODH
SCHEMBL20108081 0.84 DHODH (0.79) DHODH
SCHEMBL20108226 0.83 DHODH (1.00) DHODH
SCHEMBL29815912 0.83 DHODH (1.00) DHODH
SCHEMBL29493486 0.82 DHODH (0.77) 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
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