SCHEMBL27936544

SCHEMBL27936544

COCCOc1ccc(C(=O)Nc2ccc(OCc3cccc([N+](=O)[O-])c3)cc2)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.60
▸ MEN1 O00255 6/20 0.60
▸ KMT2A Q03164 6/20 0.60
▸ LMNA P02545 1/20 0.60
▸ ALDH1A1 P00352 2/20 0.57
▸ MET P08581 1/20 0.56
▸ MAOB P27338 2/20 0.55
▸ MAOA P21397 1/20 0.55
▸ NPC1 O15118 2/20 0.52
▸ HSP90AA1 P07900 1/20 0.52
▸ PKM P14618 1/20 0.52
▸ PAX8 Q06710 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ KLKB1 P03952 2/20 0.51
▸ RAB9A P51151 1/20 0.50

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 0.86 NPC1 (0.62) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL27936605 0.85 MAOB (0.65) MAPTALDH1A1METMAOBMAOA
SCHEMBL27918087 0.85 MAOB (0.65) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL10990654 0.82 MAOB (0.72) MAPTMAOBMAOA
SCHEMBL27792404 0.82 MEN1 (0.70) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL27936581 0.79 KLKB1 (0.78) METKLKB1
SCHEMBL27918218 0.79 KLKB1 (0.56) MAPTMEN1KMT2ALMNAMET
SCHEMBL27792367 0.75 MEN1 (0.60) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL17554366 0.75 MAOB (0.73) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL10991540 0.74 MAOB (0.70) MAOBMAOA

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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