SCHEMBL9388969

SCHEMBL9388969

CC(C)c1cc2[nH]c(=O)c(O)cc(=O)c2cc1C(C)C

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 9/20 0.41
▸ DDO Q99489 5/20 0.41
▸ SRC P12931 1/20 0.41

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
SCHEMBL9388968 0.78 KIF11 (0.49) DAODDO
SCHEMBL9393114 0.78 DAO (0.37) DAODDO
SCHEMBL9387807 0.78 RNASEH1 (0.47) DAODDO
SCHEMBL7352458 0.77 DAO (0.53) DAODDOSRC
SCHEMBL9389042 0.76 DAO (0.36) DAODDO
SCHEMBL9387604 0.75 DAO (0.55) DAODDOSRC
SCHEMBL9392765 0.74 SRC (0.44) DAODDOSRC
SCHEMBL9387925 0.74 DAO (0.53) DAODDOSRC
SCHEMBL9387780 0.73 GABRA1 (0.42) DAODDO
SCHEMBL9389347 0.73 DAO (0.43) DAODDO

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-1994007500-A1 2,5-DIHYDRO-2,5-DIOXO-1H-AZEPINES AND 2,5-DIHYDRO-2-OXO-1H-AZEPINES AND THE USE THEREOF AS EXCITATORY AMINO ACID AND GLYCINE RECEPTOR ANTAGONISTS WEBER ECKARD (US) 1994-04-14 — — WO disclosed
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