SCHEMBL20597363

SCHEMBL20597363

O/N=C/c1cccnc1/C=N/O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGF23 Q9GZV9 2/20 0.61
▸ ALDH1A1 P00352 4/20 0.49
▸ HPGD P15428 4/20 0.40
▸ TSHR P16473 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ ALOX12 P18054 1/20 0.38
▸ CTH P32929 2/20 0.37
▸ HTT P42858 3/20 0.37
▸ RRM1 P23921 1/20 0.37
▸ RRM2 P31350 1/20 0.37
▸ RRM2B Q7LG56 1/20 0.37
▸ CISD1 Q9NZ45 1/20 0.37
▸ RIPK1 Q13546 1/20 0.36
▸ LMNA P02545 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36

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
SCHEMBL16712006 0.79 FGF23 (0.45) FGF23ALDH1A1HPGDTSHRHSD17B10
SCHEMBL29402625 0.79 FGF23 (0.45) FGF23ALDH1A1HPGDTSHRHSD17B10
SCHEMBL2120978 0.78 FGF23 (0.55) FGF23ALDH1A1HPGDTSHRMAPK1
SCHEMBL5119679 0.78 NFE2L2 (0.45) FGF23ALDH1A1HPGD
SCHEMBL3927387 0.78 FGF23 (0.55) FGF23ALDH1A1HPGDTSHRMAPK1
SCHEMBL509268 0.78 AMY1A (0.57) FGF23ALDH1A1HPGDTSHRMAPK1
SCHEMBL21645883 0.78 CTH (0.54) FGF23ALDH1A1CTHHTTRRM1
SCHEMBL21645884 0.78 CTH (0.54) FGF23ALDH1A1CTHHTTRRM1
SCHEMBL20913089 0.78 CTH (0.53) FGF23ALDH1A1CTHLMNAL3MBTL1
SCHEMBL12287558 0.78 FGF23 (0.44) FGF23ALDH1A1HPGDMAPK1HSD17B10

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-3284847-B1 CORROSION INHIBITOR COMPOSITION FOR MAGNESIUM OR MAGNESIUM ALLOYS HELMHOLTZ ZENTRUM GEESTHACHT (DE) 2019-01-02 — — EP claimed
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