SCHEMBL30954752

SCHEMBL30954752

FCCOCCOc1ccc(N=Nc2ccc3scnc3c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
APP P05067 14/20 0.42
PTK6 Q13882 2/20 0.35
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL29265409 0.81 ALDH1A1 (0.45) MAPTAPPALDH1A1POLBHPGD
SCHEMBL30954747 0.81 ALDH1A1 (0.45) MAPTAPPALDH1A1POLBHPGD
SCHEMBL30954748 0.80 MAPT (0.50) MAPTAPP
SCHEMBL13394625 0.76 APP (0.43) APPALDH1A1
SCHEMBL1849483 0.75 FFAR1 (0.42) MAPTAPP
SCHEMBL30954732 0.73 MAPT (0.52) MAPTAPPL3MBTL1
SCHEMBL30954751 0.73 MAPT (0.47) MAPTAPP
SCHEMBL30954741 0.71 ALDH1A1 (0.45) MAPTPTK6ALDH1A1POLBHPGD
SCHEMBL29265410 0.71 ALDH1A1 (0.45) MAPTPTK6ALDH1A1POLBHPGD
SCHEMBL30954750 0.69 APP (0.46) MAPTAPPALDH1A1POLBSMN1; 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-118290352-A Azo compound, preparation method and application thereof, and medicinal composition 四川大学 2024-07-05 CN disclosed