SCHEMBL11593418

SCHEMBL11593418

COc1cc(OC)c(N2C(=O)c3ccccc3C2=O)cc1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN2A Q99250 1/20 0.60
▸ NR1H3 Q13133 7/20 0.51
▸ KMT2A Q03164 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ NR1H2 P55055 4/20 0.48
▸ BRD1 O95696 1/20 0.48
▸ BRPF1 P55201 1/20 0.48
▸ CYP3A4 P08684 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ PMP22 Q01453 1/20 0.45
▸ CASP6 P55212 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ ESR1 P03372 1/20 0.45
▸ GAA P10253 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43

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
SCHEMBL6156837 0.85 SCN2A (0.57) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL6005777 0.81 SCN2A (0.72) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL10915309 0.81 CYP3A4 (0.60) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL11307122 0.81 CYP3A4 (0.56) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL27712799 0.79 KMT2A (0.53) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL29168849 0.76 KMT2A (0.76) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL30758650 0.76 KMT2A (0.76) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL6392226 0.76 SCN2A (0.66) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL6679321 0.76 KMT2A (0.54) SCN2ANR1H3KMT2AMEN1NR1H2
SCHEMBL6968611 0.76 G6PD (0.59) SCN2ANR1H3KMT2AMEN1NR1H2

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
US-4122117-A Indandione bis-azomethine pigments DAINIPPON INK & CHEMICALS, INC. (JP) 1978-10-24 — — US disclosed
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