SCHEMBL27936605

SCHEMBL27936605

COCCOc1ccc(C(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2)c(O)c1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.65
▸ MAOA P21397 2/20 0.65
▸ KLKB1 P03952 3/20 0.53
▸ MET P08581 1/20 0.53
▸ FADS1 O60427 1/20 0.50
▸ MAPT P10636 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ RXRA P19793 1/20 0.49
▸ RXRB P28702 1/20 0.49
▸ RXRG P48443 1/20 0.49

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
SCHEMBL27918216 0.88 NPC1 (0.62) MAOBKLKB1METMAPTTP53
SCHEMBL27918087 0.88 MAOB (0.65) MAOBMAOAKLKB1METMAPT
SCHEMBL27918116 0.87 FADS1 (0.65) MAOBMAOAKLKB1METFADS1
SCHEMBL27936544 0.85 MAPT (0.60) MAOBMAOAKLKB1METMAPT
SCHEMBL27918126 0.83 MAOB (0.58) MAOBMAOAKLKB1MAPTNPC1
SCHEMBL27936581 0.82 KLKB1 (0.78) KLKB1MET
SCHEMBL27918218 0.81 KLKB1 (0.56) MAOBKLKB1METMAPTTP53
SCHEMBL27771283 0.80 FADS1 (0.67) MAOBMAOAMETFADS1NPC1
SCHEMBL10600292 0.78 MAOB (0.69) MAOBMAOANPC1ALDH1A1RAB9A
SCHEMBL21221792 0.76 RXRA (0.68) MAOBMAOANPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103304438-A N-substituted salicylamide type compound as well as preparation method and application thereof UNIV SHANDONG 2013-09-18 — — CN claimed
CN-103304438-B N-substituted salicylamide compounds, preparation method and application SHANDONG UNIVERSITY (CN) 2015-12-02 — — CN disclosed
CN-103304438-A N-substituted salicylamide type compound as well as preparation method and application thereof UNIV SHANDONG 2013-09-18 — — CN disclosed
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