SCHEMBL29260527

SCHEMBL29260527

N#Cc1ccc(/C=C\C2CCOCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 11/20 0.56
▸ FBP1 P09467 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.37
▸ MAPT P10636 2/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ P4HB P07237 1/20 0.36
▸ MAOA P21397 3/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL29260529 1.00 MAOB (0.56) MAOBFBP1ALDH1A1MAPTHDAC2
SCHEMBL8454093 0.83 MAOB (0.58) MAOBFBP1ALDH1A1MAPTHDAC2
SCHEMBL6011001 0.81 MAOB (0.57) MAOBFBP1ALDH1A1MAPTHDAC2
Hydrochloric Acid SCHEMBL14783054 0.80 MAOB (0.56) MAOBFBP1ALDH1A1MAPTHDAC2
SCHEMBL9457910 0.80 MAOB (0.59) MAOBFBP1ALDH1A1MAPTHDAC2
SCHEMBL9457904 0.80 MAOB (0.59) MAOBFBP1ALDH1A1MAPTHDAC2
Hydrochloric Acid SCHEMBL14783053 0.80 MAOB (0.56) MAOBFBP1ALDH1A1MAPTHDAC2
SCHEMBL24358835 0.78 MAOB (0.54) MAOBFBP1ALDH1A1MAPTHDAC2
SCHEMBL8450086 0.78 MAOB (0.53) MAOBFBP1ALDH1A1MAPTHDAC2
SCHEMBL15964288 0.78 MAOB (0.64) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118206514-A Reaction method for preparing olefin by deacylation of visible light induced ketone 国科大杭州高等研究院 2024-06-18 — — CN disclosed
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