SCHEMBL9849974

SCHEMBL9849974

C#CCN1CC(=O)Oc2cc(F)c(-n3nc(C(C)(C)C)[nH]c3=O)cc21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPOX P50336 2/20 0.31

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
SCHEMBL9641242 0.80 KDM4E (0.33)
SCHEMBL9642417 0.72
SCHEMBL9641552 0.72 GAA (0.32)
SCHEMBL9643026 0.72
SCHEMBL9641542 0.70 GRM1 (0.37)
SCHEMBL9641548 0.69 GAA (0.30)
SCHEMBL9641249 0.68 MEN1 (0.36)
SCHEMBL9849840 0.60 GAA (0.33)
SCHEMBL9641528 0.59 GAA (0.35)
SCHEMBL8603708 0.59 CHRM1 (0.32)

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-0427031-A2 N-aryl-nitrogen heterocycles BAYER AG (DE) 1991-05-15 EP disclosed