SCHEMBL30855071

SCHEMBL30855071

CCOC(=O)c1cnc2ccc(OC)cc2c1O.COc1ccc2ncc(C(=O)O)c(O)c2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.61
ALDH1A1 P00352 5/20 0.61
LMNA P02545 5/20 0.61
HPGD P15428 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
KDM4E B2RXH2 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
TP53 P04637 4/20 0.59
NMT1 P30419 3/20 0.58
KMT2A Q03164 3/20 0.54
NPSR1 Q6W5P4 3/20 0.53
HTT P42858 1/20 0.53
CLK1 P49759 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
GAA P10253 3/20 0.52
MEN1 O00255 2/20 0.52
THRB P10828 1/20 0.52
SLC2A1 P11166 1/20 0.52
NMT2 O60551 1/20 0.51
RAB9A P51151 1/20 0.50

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
SCHEMBL31603107 0.95 MAPT (0.63) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL620359 0.95 MAPT (0.63) MAPTALDH1A1LMNAHPGDSMN1; SMN2
Butane SCHEMBL3825261 0.93 MAPT (0.61) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL6148137 0.89 LMNA (0.65) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL29896399 0.88 MAPT (0.55) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL18285426 0.88 MAPT (0.55) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL618410 0.87 MAPT (0.62) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL1040706 0.85 MAPT (0.54) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL3830753 0.85 MAPT (0.60) MAPTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL621513 0.84 MAPT (0.57) MAPTALDH1A1LMNAHPGDSMN1; SMN2

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-117883445-A Application of hyperuricemia resistance of canine uric acid and structural analogue thereof in preparation of XOD inhibitor 集美大学 2024-04-16 CN disclosed