SCHEMBL28414052

SCHEMBL28414052

COc1ccc(C2=NN(C(C)=O)C(c3cccc4cc(OC)ccc34)C2)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.65
▸ CA1 P00915 2/20 0.65
▸ CA2 P00918 2/20 0.65
▸ CA9 Q16790 2/20 0.65
▸ MAOB P27338 4/20 0.65
▸ MAOA P21397 3/20 0.65
▸ EGFR P00533 4/20 0.64
▸ ERBB2 P04626 2/20 0.64
▸ ERBB3 P21860 2/20 0.64
▸ KDR P35968 2/20 0.64
▸ PTK2 Q05397 2/20 0.64
▸ NPC1 O15118 2/20 0.63
▸ RAB9A P51151 2/20 0.63
▸ MEN1 O00255 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ TERT O14746 3/20 0.57
▸ PTGS2 P35354 1/20 0.55

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
SCHEMBL28409452 0.95 CA12 (0.64) CA12CA1CA2CA9MAOB
SCHEMBL28811412 0.83 NPC1 (0.69) CA12CA1CA2CA9MAOB
SCHEMBL14540796 0.78 EGFR (0.68) CA12CA1CA2CA9MAOB
SCHEMBL28418909 0.77 EGFR (0.64) CA1CA2EGFRERBB2ERBB3
SCHEMBL27790823 0.74 MAOA (1.00) CA12CA1CA2CA9MAOB
SCHEMBL23052465 0.74 NPC1 (0.71) MAOBMAOAEGFRNPC1RAB9A
SCHEMBL21440072 0.74 MAOB (0.81) CA12CA1CA2CA9MAOB
SCHEMBL23052167 0.74 NPC1 (0.71) MAOBMAOAEGFRNPC1RAB9A
SCHEMBL15436205 0.74 MAOB (0.81) CA12CA1CA2CA9MAOB
SCHEMBL30751940 0.73 MAOA (0.76) CA12CA1CA2CA9MAOB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107820941-B Antioxidant light-converting agricultural plastic film and preparation method thereof 盐城保荣机械有限公司 2020-05-15 — — CN claimed
CN-107820941-B Antioxidant light-converting agricultural plastic film and preparation method thereof 盐城保荣机械有限公司 2020-05-15 — — CN disclosed
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