SCHEMBL17970189

SCHEMBL17970189

CCCOC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(OC(C)=O)cc2Oc2cc(OC(C)=O)ccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.66
▸ KMT2A Q03164 3/20 0.66
▸ LMNA P02545 3/20 0.66
▸ ALDH1A1 P00352 2/20 0.66
▸ MEN1 O00255 2/20 0.66
▸ HTT P42858 2/20 0.66
▸ USP2 O75604 1/20 0.66
▸ GSTP1 P09211 1/20 0.64
▸ CYP3A4 P08684 1/20 0.50
▸ FTO Q9C0B1 8/20 0.43
▸ KCNH2 Q12809 1/20 0.42
▸ HPGD P15428 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ SMAD3 P84022 1/20 0.40
▸ PRMT1 Q99873 1/20 0.40
▸ ACE2 Q9BYF1 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ CNR1 P21554 1/20 0.38

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
SCHEMBL29672382 0.89 MAPT (0.67) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL17956700 0.86 FTO (0.57) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL18677730 0.85 MAPT (0.77) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL29663660 0.84 MEN1 (0.75) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL29485015 0.84 MEN1 (0.75) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL6663204 0.84 MEN1 (0.75) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL17970190 0.84 KMT2A (0.66) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL17956695 0.81 ALDH1A1 (0.41) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL30224109 0.81 MEN1 (0.72) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL22434375 0.81 MAPT (0.63) MAPTKMT2ALMNAALDH1A1MEN1

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-3050886-A1 Fluorescent dyes and dye precursors Bürkert Werke GmbH (DE) 2016-08-03 — — EP disclosed
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