SCHEMBL28823398

SCHEMBL28823398

CCn1c(SC)nn(-c2cc(OC(C)C(F)(F)F)c(C(=O)Nc3c(F)cccc3F)cc2F)c1=O

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
SCHEMBL20107951 1.00 DHODH (1.00) DHODH
SCHEMBL29816499 1.00 DHODH (1.00) DHODH
SCHEMBL21853499 0.90 DHODH (1.00) DHODH
SCHEMBL29816757 0.90 DHODH (1.00) DHODH
SCHEMBL20108034 0.90 DHODH (1.00) DHODH
SCHEMBL29815334 0.89 DHODH (1.00) DHODH
SCHEMBL29815921 0.89 DHODH (1.00) DHODH
SCHEMBL20107734 0.89 DHODH (1.00) DHODH
SCHEMBL20108254 0.89 DHODH (1.00) DHODH
SCHEMBL25325163 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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