SCHEMBL5695419

SCHEMBL5695419

COc1cc(C=C2Nc3ccccc3C2=O)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.64
▸ KMT2A Q03164 5/20 0.64
▸ ALDH1A1 P00352 3/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ GAA P10253 2/20 0.57
▸ MAPK1 P28482 2/20 0.57
▸ MIF P14174 2/20 0.57
▸ CES2 O00748 1/20 0.57
▸ STK17B O94768 1/20 0.57
▸ MEN1 O00255 4/20 0.56
▸ HPGD P15428 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ PSMB5 P28074 1/20 0.55
▸ PSMB2 P49721 1/20 0.55
▸ PAX8 Q06710 1/20 0.54
▸ MAOB P27338 1/20 0.54
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.53

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
SCHEMBL5695458 1.00 MAPT (0.64) MAPTKMT2AALDH1A1L3MBTL1GAA
SCHEMBL5695423 0.88 MAPT (0.60) MAPTKMT2AALDH1A1L3MBTL1GAA
SCHEMBL5695413 0.88 MAPT (0.60) MAPTKMT2AALDH1A1L3MBTL1GAA
SCHEMBL5469654 0.82 DHFR (0.77) MAPTKMT2AALDH1A1L3MBTL1GAA
SCHEMBL14448907 0.82 DHFR (0.77) MAPTKMT2AALDH1A1L3MBTL1GAA
SCHEMBL5469649 0.82 DHFR (0.77) MAPTKMT2AALDH1A1L3MBTL1GAA
SCHEMBL19453394 0.80 CGAS (0.59) MAPTKMT2AALDH1A1L3MBTL1GAA
SCHEMBL5695417 0.79 MAPT (0.69) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL5695414 0.79 MAPT (0.69) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL10848654 0.79 TYR (0.57) MAPTKMT2AALDH1A1L3MBTL1GAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300135-B1 Agent for dyeing keratinous fibres comprising 2-aryliden-indolin-3-one derivatives HENKEL KGAA (DE) 2006-05-03 — — EP claimed
EP-1300135-A1 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 — — EP claimed
EP-1300135-B1 Agent for dyeing keratinous fibres comprising 2-aryliden-indolin-3-one derivatives HENKEL KGAA (DE) 2006-05-03 — — EP disclosed
EP-1300135-A1 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 — — EP disclosed
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