SCHEMBL23557979

SCHEMBL23557979

O=C(Cn1cnc2c(Cl)nccc21)N1CCC1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 17/20 0.46
▸ GRIN1 Q05586 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ PTGS2 P35354 1/20 0.43
▸ POLB P06746 1/20 0.42

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
SCHEMBL23557973 0.97 MAPT (0.46) GRIN2BGRIN1MAPTPTGS2POLB
SCHEMBL23531695 0.80 EGLN1 (0.48) PTGS2POLB
SCHEMBL21603316 0.79 GRIN2B (0.50) GRIN2B
SCHEMBL21603319 0.76 GRIN2B (0.48) GRIN2B
SCHEMBL29825072 0.76 GRIN2B (0.44) GRIN2BGRIN1
SCHEMBL23531724 0.76 GRIN2B (0.44) GRIN2BGRIN1
SCHEMBL30015306 0.73 FPR2 (0.43) POLB
SCHEMBL23558005 0.73 FPR2 (0.43) POLB
SCHEMBL23557976 0.73 GRIN2B (0.43) GRIN2BGRIN1
SCHEMBL23531656 0.72 GRIN2B (0.38) GRIN2BGRIN1

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-2021123294-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-06-24 — — WO disclosed
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