SCHEMBL10270912

SCHEMBL10270912

CN1N=C(N)/C(=C/c2cccs2)C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.50
▸ ALDH1A1 P00352 9/20 0.50
▸ HPGD P15428 5/20 0.50
▸ L3MBTL1 Q9Y468 4/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ PKM P14618 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ POLB P06746 3/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ KMT2A Q03164 7/20 0.47
▸ HTT P42858 1/20 0.47
▸ MEN1 O00255 6/20 0.47
▸ GAA P10253 3/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ EP300 Q09472 1/20 0.44
▸ KAT8 Q9H7Z6 1/20 0.44
▸ MAPK1 P28482 2/20 0.44

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
SCHEMBL14610263 0.82 MAPT (0.50) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL6657924 0.68 MAPT (0.57) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL6657919 0.68 MAPT (0.57) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL29518176 0.67 MAPT (1.00) MAPTALDH1A1HPGDL3MBTL1TDP1
Ammonia Solution, Strong SCHEMBL8088133 0.66 MAPT (0.97) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL9198596 0.66 ALDH1A1 (0.54) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL17971664 0.65 KMT2A (1.00) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL11153579 0.65 MAPT (0.70) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL14016121 0.63 ALDH1A1 (0.43) MAPTALDH1A1HPGDL3MBTL1TDP1
SCHEMBL11153582 0.63 MAPT (0.49) MAPTALDH1A1HPGDL3MBTL1TDP1

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-2012015076-A1 POLYMERIZABLE COMPOSITION FUJIFILM CORPORATION (JP) 2012-02-02 — — WO disclosed
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