SCHEMBL2823183

SCHEMBL2823183

Cc1ccc(Nc2cnc(-c3cccc(C(=O)N4CCCC4)c3)c(C)c2)c(C(=O)O)c1.Cc1ccc(Nc2cnc(-c3cccc(C(=O)NC4CC4)c3)c(C)c2)c(C(=O)O)c1.Cc1ccc(Nc2cnc(-c3ccccc3Cl)nc2)c(C(=O)O)c1.O=C(O)c1cc(C2CC2)ccc1Nc1cnc(-c2ccccc2F)nc1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.61

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
SCHEMBL2823180 1.00 DHODH (0.61) DHODH
SCHEMBL2821833 0.86 DHODH (0.50) DHODH
SCHEMBL468557 0.78 DHODH (1.00) DHODH
SCHEMBL468473 0.78 DHODH (1.00) DHODH
SCHEMBL468581 0.72 DHODH (1.00) DHODH
SCHEMBL467948 0.72 DHODH (1.00) DHODH
SCHEMBL2822036 0.71 DHODH (0.58) DHODH
SCHEMBL2825697 0.71 DHODH (0.82) DHODH
SCHEMBL468558 0.71 DHODH (1.00) DHODH
SCHEMBL468654 0.71 DHODH (0.82) 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
EP-2178840-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS Almirall, S.A. (ES) 2010-04-28 EP claimed
WO-2009021696-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL, S.A. (ES) 2009-02-19 WO claimed