SCHEMBL9388994

SCHEMBL9388994

O=c1[nH]c2cc(I)cc(I)c2c(=O)cc1O

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GPR17 Q13304 1/20 0.42
▸ DAO P14920 7/20 0.40
▸ DDO Q99489 3/20 0.40

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
SCHEMBL9392798 0.83 DAO (0.49) DAO
SCHEMBL9393329 0.83 DAO (0.49) DAODDO
SCHEMBL9389356 0.78 DAO (0.50) GPR17DAODDO
SCHEMBL9392883 0.75 DAO (0.42) DAODDO
SCHEMBL9387619 0.72 DAO (0.40) DAODDO
SCHEMBL9392833 0.72 DAO (0.39) DAODDO
SCHEMBL9393343 0.72 DAO (0.46) DAODDO
SCHEMBL9392765 0.71 SRC (0.44) DAODDO
SCHEMBL9389020 0.70 GRIN2D (0.55) DAODDO
SCHEMBL9390057 0.70 DAO (0.44) 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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