SCHEMBL16900582

SCHEMBL16900582

CN1CCCc2cc(O)c(O)cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.49
▸ GAA P10253 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ KDM4E B2RXH2 3/20 0.41
▸ PKM P14618 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAOA P21397 1/20 0.41
▸ DRD2 P14416 4/20 0.39
▸ DRD1 P21728 4/20 0.39
▸ DRD4 P21917 4/20 0.39
▸ DRD5 P21918 4/20 0.39
▸ PDK1 Q15118 1/20 0.38
▸ PDK2 Q15119 1/20 0.38
▸ PDK3 Q15120 1/20 0.38
▸ PDK4 Q16654 1/20 0.38
▸ GLA P06280 1/20 0.37
▸ CASP1 P29466 1/20 0.37

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
SCHEMBL111786 0.88 MAOA (0.47) MAPTKDM4EMAOADRD2DRD1
SCHEMBL29803269 0.88 MAOA (0.47) MAPTKDM4EMAOADRD2DRD1
Bromide SCHEMBL4625297 0.86 DRD1 (0.47) MAPTKDM4EMAOADRD2DRD1
SCHEMBL14283936 0.85 ALDH1A1 (0.44) ALDH1A1GAAMEN1MAPTKMT2A
SCHEMBL10105431 0.83 ALDH1A1 (0.42) ALDH1A1GAAMEN1MAPTKMT2A
SCHEMBL21973574 0.81 ALDH1A1 (0.44) ALDH1A1GAAMEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL9737645 0.80 ALDH1A1 (0.43) ALDH1A1GAAMEN1MAPTKMT2A
SCHEMBL10105246 0.80 ALDH1A1 (0.40) ALDH1A1GAAMEN1MAPTKMT2A
SCHEMBL15628980 0.78 ALDH1A1 (0.50) ALDH1A1GAAMEN1MAPTKMT2A
SCHEMBL3178012 0.77 MEN1 (0.58) ALDH1A1GAAMEN1MAPTKMT2A

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
EP-1515192-B1 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH CO LTD (JP) 2015-07-15 — — EP disclosed
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