SCHEMBL28452875

SCHEMBL28452875

O=[N+]([O-])c1ccc(-c2cc3cc4nc(cc5ccc(cc6nc(cc2[nH]3)C=C6)[nH]5)C=C4)cc1.[Cu]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.45
▸ NPC1 O15118 7/20 0.45
▸ RAB9A P51151 7/20 0.45
▸ HTT P42858 6/20 0.45
▸ MMP2 P08253 4/20 0.45
▸ MMP9 P14780 4/20 0.45
▸ MMP8 P22894 4/20 0.45
▸ MMP13 P45452 3/20 0.45
▸ CASP3 P42574 2/20 0.45
▸ SENP8 Q96LD8 2/20 0.45
▸ SENP7 Q9BQF6 2/20 0.45
▸ SENP6 Q9GZR1 2/20 0.45
▸ IDO1 P14902 1/20 0.41
▸ NPBWR1 P48145 10/20 0.39
▸ SMN1; SMN2 Q16637 6/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ NFKB1 P19838 3/20 0.39
▸ NFKB2 Q00653 3/20 0.39
▸ RELA Q04206 3/20 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
SCHEMBL9091739 0.99 MAPT (0.46) MAPTNPC1RAB9AHTTMMP2
SCHEMBL28459083 0.97 MAPT (0.45) MAPTNPC1RAB9AHTTMMP2
SCHEMBL28456721 0.97 MAPT (0.45) MAPTNPC1RAB9AHTTMMP2
SCHEMBL28450629 0.97 MAPT (0.45) MAPTNPC1RAB9AHTTMMP2
SCHEMBL27894214 0.86 MAPT (0.45) MAPTRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL10719640 0.85 MAPT (0.49) MAPTNPC1RAB9AHTTMMP2
SCHEMBL28002967 0.85 MAPT (0.46) MAPTNPC1RAB9AHTTMMP2
SCHEMBL4544258 0.80 STAT3 (0.57) MAPTNPC1RAB9AHTTMMP2
SCHEMBL28755178 0.80 NPBWR1 (0.39) MAPTNPC1RAB9AHTTMMP2
SCHEMBL29000848 0.80 STAT3 (0.37) MAPTNPC1RAB9AHTTNPBWR1

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-111617644-B Preparation method of monolithic polyaryletherketone bipolar membrane with side chain containing porphyrin water dissociation catalytic group 福建师范大学 2022-03-15 — — CN disclosed
CN-111617644-A Preparation method of monolithic polyaryletherketone bipolar membrane with side chain containing porphyrin water dissociation catalytic group 福建师范大学 2020-09-04 — — CN disclosed
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