SCHEMBL6859682

SCHEMBL6859682

CCOc1c(-c2ccccc2)cc(F)c(NC(=O)C2=C(C(=O)O)CCC2)c1F

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.64
NR4A2 P43354 8/20 0.54

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
SCHEMBL6814715 0.91 DHODH (0.66) DHODHNR4A2
SCHEMBL6814538 0.83 DHODH (0.53) DHODHNR4A2
SCHEMBL251960 0.82 DHODH (0.79) DHODHNR4A2
SCHEMBL502818 0.78 DHODH (1.00) DHODHNR4A2
SCHEMBL6754115 0.78 DHODH (0.60) DHODHNR4A2
SCHEMBL248162 0.75 DHODH (0.62) DHODHNR4A2
SCHEMBL6754645 0.73 DHODH (0.65) DHODHNR4A2
SCHEMBL6756236 0.73 DHODH (0.58) DHODHNR4A2
SCHEMBL3924977 0.73 DHODH (0.63) DHODHNR4A2
SCHEMBL254108 0.73 DHODH (1.00) DHODHNR4A2

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-1392642-A2 NOVEL COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS 4SC AG (DE) 2004-03-03 EP disclosed
WO-2003006425-A2 NOVEL COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS 4SC AG (DE) 2003-01-23 WO disclosed