SCHEMBL31753907

SCHEMBL31753907

O=C(O)c1ccc(-n2cnc(C(=O)O)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.49
TP53 P04637 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
CA12 O43570 2/20 0.44
CA9 Q16790 2/20 0.44
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
TSHR P16473 1/20 0.43
NOTUM Q6P988 1/20 0.42
POLB P06746 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
APEX1 P27695 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
DDAH1 O94760 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
SCHEMBL3529890 0.85 SMN1; SMN2 (0.57) MAPTTP53SMN1; SMN2TSHRPOLB
SCHEMBL15760357 0.84 NOTUM (0.48) MAPTTP53SMN1; SMN2TSHRNOTUM
SCHEMBL31301264 0.84 MAPT (0.52) MAPTTP53SMN1; SMN2NOTUMPOLB
SCHEMBL15754705 0.84 MAPT (0.44) MAPTTP53SMN1; SMN2NOTUMPOLB
SCHEMBL15753929 0.84 TP53 (0.61) MAPTTP53SMN1; SMN2NOTUMPOLB
SCHEMBL31301332 0.80 MAPT (0.55) MAPTTP53SMN1; SMN2NOTUMPOLB
SCHEMBL31301425 0.80 TP53 (0.44) MAPTTP53SMN1; SMN2NOTUMPOLB
SCHEMBL31301291 0.80 MAPT (0.45) MAPTTP53SMN1; SMN2TSHRNOTUM
SCHEMBL31301405 0.80 NOTUM (0.45) MAPTTP53SMN1; SMN2NOTUMPOLB
SCHEMBL15464739 0.80 ACKR3 (0.47) MAPTTP53SMN1; SMN2NOTUMPOLB

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
CN-121226759-A Two-dimensional hydrogen bond organic framework material room temperature phosphor for multiple encryption display 郑州大学 2025-12-30 CN disclosed