SCHEMBL29546015

SCHEMBL29546015

COC(=O)Cc1ncc(-c2ccc3c(c2)c(C(C)=O)nn3CC(=O)O)cn1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CFD P00746 19/20 0.45
MAPT P10636 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
SCHEMBL18578379 1.00 CFD (0.45) CFDMAPT
SCHEMBL18555313 0.90 CFD (0.46) CFD
SCHEMBL29545221 0.90 CFD (0.46) CFD
SCHEMBL29468575 0.88 CFD (0.43) CFD
SCHEMBL18591350 0.88 CFD (0.43) CFD
SCHEMBL29544797 0.87 CFD (0.45) CFD
SCHEMBL18555055 0.87 CFD (0.46) CFD
SCHEMBL18554877 0.87 CFD (0.45) CFD
SCHEMBL29544989 0.87 CFD (0.46) CFD
SCHEMBL18578337 0.86 CFD (0.46) CFD

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-114044800-A Aryl, heteroaryl and heterocyclic compounds for the treatment of medical disorders 艾其林医药公司 2022-02-15 CN disclosed