SCHEMBL28861966

SCHEMBL28861966

O=C1/C(=C/c2ccccc2)N(c2ccccc2)C(=O)N1c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ITGA4 P13612 3/20 0.50
▸ ITGB7 P26010 3/20 0.50
▸ NOX4 Q9NPH5 5/20 0.47
▸ CYBB P04839 4/20 0.47
▸ NOX1 Q9Y5S8 1/20 0.47
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ S1PR1 P21453 1/20 0.42
▸ S1PR3 Q99500 1/20 0.42
▸ PTPN1 P18031 1/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ THRB P10828 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39

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
SCHEMBL28232595 0.85 MAPT (0.52) MEN1KMT2AS1PR1S1PR3MGLL
SCHEMBL2851080 0.77 MGLL (0.56) MEN1KMT2AMGLLGAA
SCHEMBL28373918 0.76 ITGA4 (0.49) ITGA4ITGB7NOX4CYBBNOX1
SCHEMBL11283647 0.75 ALDH1A1 (0.51) NOX4CYBBNOX1MEN1KMT2A
SCHEMBL11283649 0.75 ALDH1A1 (0.51) NOX4CYBBNOX1MEN1KMT2A
SCHEMBL2928174 0.73 GAA (0.57) MEN1KMT2AMGLLGAA
SCHEMBL11974224 0.73 NOX4 (0.44) NOX4CYBBNOX1MEN1KMT2A
SCHEMBL10957579 0.73 TGM2 (0.42) ITGA4ITGB7MEN1KMT2AMAPT
SCHEMBL10957583 0.73 TGM2 (0.42) ITGA4ITGB7MEN1KMT2AMAPT
SCHEMBL11182628 0.72 MGLL (0.62) MEN1KMT2AMGLLGAA

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-108329268-A A kind of synthetic method of hydantoin derivatives 淮海工学院 2018-07-27 — — CN disclosed
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