SCHEMBL24063060

SCHEMBL24063060

O=C(O)[C@@H]1Cc2cncnc2N1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ NNMT P40261 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MME P08473 4/20 0.31
▸ ACE P12821 3/20 0.31
▸ EGLN1 Q9GZT9 1/20 0.31

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
SCHEMBL28518825 0.81 CYP46A1 (0.38) NNMTALDH1A1HSD17B10
SCHEMBL2608533 0.74 GAA (0.41) MAPTGAANNMT
SCHEMBL16464959 0.73 MAPT (0.56) MAPTGAAALDH1A1KDM4EHSD17B10
SCHEMBL16464958 0.73 MAPT (0.56) MAPTGAAALDH1A1KDM4EHSD17B10
SCHEMBL2608547 0.73 MAPT (0.56) MAPTGAAALDH1A1KDM4EHSD17B10
SCHEMBL29550106 0.73 MAPT (0.56) MAPTGAAALDH1A1KDM4EHSD17B10
Hydrochloric Acid SCHEMBL18103843 0.72 MAPT (0.54) MAPTGAAALDH1A1KDM4EHSD17B10
SCHEMBL28595338 0.71 NNMT (0.32) NNMT
SCHEMBL29153653 0.71 NNMT (0.39) MAPTGAANNMTALDH1A1KDM4E
SCHEMBL29153655 0.71 NNMT (0.39) MAPTGAANNMTALDH1A1KDM4E

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
EP-3916003-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME Naurex, Inc. (US) 2021-12-01 — — EP disclosed
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