SCHEMBL20112698

SCHEMBL20112698

Cc1cc(F)ccc1NC(=O)c1cc(Cl)c(-n2nc3n(c2=O)CCCC3)cc1O

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.74

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
SCHEMBL20112695 0.85 DHODH (1.00) DHODH
SCHEMBL29510110 0.85 DHODH (1.00) DHODH
SCHEMBL20112725 0.84 DHODH (0.75) DHODH
SCHEMBL20112672 0.82 DHODH (0.73) DHODH
SCHEMBL20112455 0.82 DHODH (0.72) DHODH
SCHEMBL20112218 0.82 DHODH (0.60) DHODH
SCHEMBL20112718 0.80 DHODH (0.73) DHODH
SCHEMBL20112377 0.78 DHODH (0.76) DHODH
SCHEMBL20112752 0.78 DHODH (0.48) DHODH
SCHEMBL20112773 0.78 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018077944-A2 4,5-ANNULATED 1,2,4-TRIAZOLONES BAYER AKTIENGESELLSCHAFT (DE) 2018-05-03 WO disclosed