SCHEMBL468874

SCHEMBL468874

CCc1ccc(Nc2cnc(-c3cccc(C(=O)N(C)C)c3)c(C)c2)c(C(=O)O)c1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.80

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
SCHEMBL468422 0.89 DHODH (1.00) DHODH
SCHEMBL3667236 0.87 DHODH (0.85) DHODH
SCHEMBL468503 0.83 DHODH (0.78) DHODH
SCHEMBL15789871 0.82 DHODH (0.71) DHODH
SCHEMBL15401638 0.82 DHODH (0.80) DHODH
SCHEMBL15401201 0.80 DHODH (0.62) DHODH
SCHEMBL468446 0.77 DHODH (1.00) DHODH
SCHEMBL15401186 0.76 DHODH (0.78) DHODH
SCHEMBL3664567 0.76 DHODH (0.84) DHODH
SCHEMBL468722 0.74 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
EP-2389197-A1 COMBINATIONS COMPRISING METHOTREXATE AND DHODH INHIBITORS Almirall S.A. (ES) 2011-11-30 EP claimed
US-20110253957-A1 Compliant motion distribution system FLEXSYS, INC. 2011-10-20 US claimed
WO-2010083975-A1 COMBINATIONS COMPRISING METHOTREXATE AND DHODH INHIBITORS ALMIRALL, S.A. (ES) 2010-07-29 WO claimed