SCHEMBL9138508

SCHEMBL9138508

COC(C)OC(C)Oc1cc(-n2nc(C)n(OC)c2=O)c(F)cc1C#N

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.35

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
SCHEMBL9141549 0.85 NR1I2 (0.35) DHODH
SCHEMBL9138271 0.81 TRPV4 (0.33) DHODH
SCHEMBL9139456 0.81 TP53 (0.35) DHODH
SCHEMBL9137180 0.79 ALDH1A1 (0.41) DHODH
SCHEMBL9138501 0.78 DHODH (0.32) DHODH
SCHEMBL9138504 0.77 AR (0.37) DHODH
SCHEMBL8786806 0.72 NR1I2 (0.35) DHODH
SCHEMBL9138522 0.72 PPOX (0.37)
SCHEMBL21853413 0.71 DHODH (0.61) DHODH
SCHEMBL21853412 0.71 DHODH (0.61) 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
US-5378681-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1995-01-03 US claimed