SCHEMBL21588488

SCHEMBL21588488

Brc1ccc(N2CC3OC[C@@H]32)nc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.36
▸ GRIN3B O60391 1/20 0.36
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2A Q12879 1/20 0.36
▸ GRIN2B Q13224 1/20 0.36
▸ GRIN2C Q14957 1/20 0.36
▸ GRIN3A Q8TCU5 1/20 0.36
▸ AKR1C3 P42330 1/20 0.36
▸ USP30 Q70CQ3 7/20 0.35
▸ PDE10A Q9Y233 1/20 0.33
▸ ACACB O00763 1/20 0.31
▸ OGA O60502 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ ALDH1A1 P00352 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
SCHEMBL24195082 0.83 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24195083 0.83 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL22000882 0.81 CNR2 (0.35) USP30PDE10A
SCHEMBL21154527 0.81 CNR2 (0.35) USP30PDE10A
SCHEMBL21154010 0.81 CNR2 (0.35) USP30PDE10A
SCHEMBL21154522 0.81 CNR2 (0.35) USP30PDE10A
SCHEMBL21999969 0.81 CNR2 (0.35) USP30PDE10A
SCHEMBL26248564 0.78 ACACB (0.37) USP30ACACBOGA
SCHEMBL22425261 0.77 USP30 (0.36) USP30ACACBKDM4EALDH1A1
SCHEMBL21154012 0.74 PLD1 (0.38) 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
WO-2019233883-A1 TETRAHYDROBENZOFURO[2,3-C]PYRIDINE AND BETA-CARBOLINE COMPOUNDS FOR THE TREATMENT, ALLEVIATION OR PREVENTION OF DISORDERS ASSOCIATED WITH TAU AGGREGATES AC IMMUNE SA (CH) 2019-12-12 — — WO disclosed
Send feedback