SCHEMBL29816699

SCHEMBL29816699

CCn1c(CO)nn(-c2ccc(C(=O)Nc3c(F)cccc3Cl)c(O[C@@H](C)C(F)(F)F)c2)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
SCHEMBL20108245 1.00 DHODH (1.00) DHODH
SCHEMBL28823394 1.00 DHODH (1.00) DHODH
SCHEMBL29815321 0.95 DHODH (1.00) DHODH
SCHEMBL20107835 0.95 DHODH (1.00) DHODH
SCHEMBL20107985 0.90 DHODH (1.00) DHODH
SCHEMBL29815778 0.90 DHODH (1.00) DHODH
SCHEMBL21469097 0.90 DHODH (0.91) DHODH
SCHEMBL21435683 0.90 DHODH (1.00) DHODH
SCHEMBL20108031 0.90 DHODH (1.00) DHODH
SCHEMBL29440589 0.90 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