SCHEMBL3665995

SCHEMBL3665995

CCOC(=O)c1cc(C)ccc1Nc1cnc(-c2cc(OC)ccc2F)c(C)c1.COc1ccc(F)c(-c2ncc(Nc3ccc(C)cc3C(=O)O)cc2C)c1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.64

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
SCHEMBL468368 0.97 DHODH (0.58) DHODH
SCHEMBL468553 0.93 DHODH (0.73) DHODH
SCHEMBL3668796 0.81 DHODH (0.82) DHODH
SCHEMBL468702 0.80 DHODH (0.79) DHODH
SCHEMBL3670557 0.80 DHODH (0.71) DHODH
SCHEMBL468583 0.79 DHODH (1.00) DHODH
SCHEMBL468622 0.78 DHODH (1.00) DHODH
SCHEMBL468664 0.78 DHODH (0.76) DHODH
SCHEMBL3666606 0.78 DHODH (0.87) DHODH
SCHEMBL3670180 0.77 DHODH (0.76) 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
EP-2210615-A1 Combinations comprising methotrexate and DHODH inhibitors Almirall, S.A. (ES) 2010-07-28 EP claimed