SCHEMBL30967767

SCHEMBL30967767

CC(O)c1cnc(-c2cccc(Oc3c(F)cc4[nH]ccc4c3F)c2)[nH]1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 3/20 0.33
▸ GRIN2D O15399 1/20 0.33
▸ GRIN3B O60391 1/20 0.33
▸ GRIN1 Q05586 1/20 0.33
▸ GRIN2A Q12879 1/20 0.33
▸ GRIN2B Q13224 1/20 0.33
▸ GRIN2C Q14957 1/20 0.33
▸ GRIN3A Q8TCU5 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ RHEB Q15382 3/20 0.31
▸ CDK8 P49336 1/20 0.31
▸ NPY5R Q15761 1/20 0.31
▸ BACE1 P56817 3/20 0.31
▸ BACE2 Q9Y5Z0 1/20 0.31
▸ CNR1 P21554 1/20 0.30
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL30217356 0.83 BACE1 (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30217092 0.83 BACE1 (0.32) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30217308 0.82 PLAU (0.33) BACE1BACE2
SCHEMBL30217076 0.80 KDM4E (0.35) KDM4EALDH1A1BACE1BACE2
SCHEMBL30217199 0.80 CDK8 (0.33) KDM4EALDH1A1CDK8BACE1BACE2
SCHEMBL29336768 0.79 GRIN2D (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30285407 0.79 GRIN2D (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30217297 0.78 FFAR4 (0.34) CDK8BACE1BACE2
SCHEMBL30285449 0.78 BACE1 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29336583 0.78 BACE1 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
CN-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 — — CN disclosed
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