SCHEMBL5695423

SCHEMBL5695423

COc1ccc(/C=C2\Nc3ccccc3C2=O)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.60
▸ KMT2A Q03164 6/20 0.60
▸ MEN1 O00255 4/20 0.60
▸ HPGD P15428 4/20 0.60
▸ HTT P42858 1/20 0.60
▸ ALDH1A1 P00352 8/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ HDAC3 O15379 1/20 0.54
▸ STK17B O94768 1/20 0.54
▸ HDAC4 P56524 1/20 0.54
▸ HDAC1 Q13547 1/20 0.54
▸ HDAC7 Q8WUI4 1/20 0.54
▸ HDAC2 Q92769 1/20 0.54
▸ HDAC10 Q969S8 1/20 0.54
▸ HDAC11 Q96DB2 1/20 0.54
▸ HDAC8 Q9BY41 1/20 0.54
▸ HDAC6 Q9UBN7 1/20 0.54
▸ HDAC9 Q9UKV0 1/20 0.54
▸ HDAC5 Q9UQL6 1/20 0.54
▸ SMN1; SMN2 Q16637 4/20 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
SCHEMBL5695413 1.00 MAPT (0.60) MAPTKMT2AMEN1HPGDHTT
SCHEMBL5695458 0.88 MAPT (0.64) MAPTKMT2AMEN1HPGDHTT
SCHEMBL5695419 0.88 MAPT (0.64) MAPTKMT2AMEN1HPGDHTT
SCHEMBL5695414 0.82 MAPT (0.69) MAPTKMT2AMEN1HPGDHTT
SCHEMBL10848654 0.82 TYR (0.57) MAPTKMT2AMEN1HPGDHTT
SCHEMBL5695417 0.82 MAPT (0.69) MAPTKMT2AMEN1HPGDHTT
SCHEMBL7843430 0.81 ERBB2 (0.76) MAPTHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL5477780 0.81 ERBB2 (0.76) MAPTHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL5477779 0.81 ERBB2 (0.76) MAPTHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL10853940 0.81 MAPT (0.89) MAPTKMT2AMEN1HPGDHTT

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-1300135-B1 Agent for dyeing keratinous fibres comprising 2-aryliden-indolin-3-one derivatives HENKEL KGAA (DE) 2006-05-03 — — EP claimed
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