SCHEMBL29486349

SCHEMBL29486349

O=[N+]([O-])c1ccc(-n2ccnc2)cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.50
MKNK1 Q9BUB5 1/20 0.50
MKNK2 Q9HBH9 1/20 0.50
MAPT P10636 4/20 0.49
SIRT6 Q8N6T7 1/20 0.49
THRB P10828 1/20 0.49
PKM P14618 1/20 0.49
GPR35 Q9HC97 1/20 0.46
GRIA1 P42261 2/20 0.46
GRIA2 P42262 2/20 0.46
GRIA3 P42263 2/20 0.46
GRIA4 P48058 2/20 0.46
GRIK1 P39086 1/20 0.46
GRIK2 Q13002 1/20 0.46
GRIK3 Q13003 1/20 0.46
GRIK4 Q16099 1/20 0.46
GRIK5 Q16478 1/20 0.46
CYP19A1 P11511 2/20 0.45
IDO1 P14902 1/20 0.45
CYP11B1 P15538 1/20 0.45

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
SCHEMBL27807398 0.86 GRIA1 (0.49) ENPP2MKNK1MKNK2MAPTGRIA1
SCHEMBL1067164 0.82 LMNA (0.52) ENPP2MKNK1MKNK2MAPTSIRT6
SCHEMBL1839319 0.82 HPGD (0.51) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL20536197 0.82 CYP19A1 (0.52) ENPP2MKNK1MKNK2MAPTGRIA1
SCHEMBL17630137 0.82 GRIA1 (0.46) ENPP2MKNK1MKNK2MAPTGRIA1
SCHEMBL7470078 0.81 MAPT (0.46) ENPP2MKNK1MKNK2MAPTGRIA1
SCHEMBL6964006 0.79 IDO1 (0.53) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL16151007 0.79 MAPT (0.50) ENPP2MKNK1MKNK2MAPTGRIA1
SCHEMBL10902263 0.79 MAPT (0.47) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL7425462 0.79 PDE2A (0.46) ENPP2MKNK1MKNK2MAPTGRIA1

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-2022060943-A1 COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. (US) 2022-03-24 WO disclosed