SCHEMBL2848357

SCHEMBL2848357

Cc1cc([AsH]c2ccc(C3CC3)cc2C(=O)O)cnc1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 18/20 0.62
LDHA P00338 1/20 0.38
PTGFR P43088 1/20 0.37

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
SCHEMBL468558 0.77 DHODH (1.00) DHODH
SCHEMBL2844577 0.71 DHODH (0.61) DHODH
SCHEMBL2731142 0.71 DHODH (0.52) DHODH
SCHEMBL3668556 0.70 DHODH (0.84) DHODH
SCHEMBL15789849 0.69 DHODH (0.69) DHODH
SCHEMBL468607 0.68 DHODH (0.79) DHODH
SCHEMBL17067813 0.67 ACMSD (0.57) DHODH
SCHEMBL2872503 0.67 SLC6A3 (0.43) DHODH
SCHEMBL468593 0.67 DHODH (1.00) DHODH
SCHEMBL13341537 0.66 DHODH (0.48) 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 disclosed
WO-2009021696-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL, S.A. (ES) 2009-02-19 WO disclosed