SCHEMBL365399

SCHEMBL365399

CCCOC(=O)c1c2ccc(O)cc2n2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.53
▸ KDM4E B2RXH2 7/20 0.53
▸ KMT2A Q03164 6/20 0.53
▸ MAPT P10636 5/20 0.53
▸ MEN1 O00255 5/20 0.53
▸ SAE1 Q9UBE0 2/20 0.53
▸ UBA2 Q9UBT2 2/20 0.53
▸ APAF1 O14727 1/20 0.53
▸ G6PD P11413 1/20 0.53
▸ PABPC1 P11940 1/20 0.53
▸ CACNA1B Q00975 1/20 0.53
▸ APBA1 Q02410 1/20 0.53
▸ LMNA P02545 5/20 0.46
▸ GAA P10253 5/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ NCOA3 Q9Y6Q9 1/20 0.46
▸ HPGD P15428 3/20 0.46
▸ XBP1 P17861 1/20 0.46
▸ MPI P34949 1/20 0.46

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
SCHEMBL365893 0.93 ALDH1A1 (0.53) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL366764 0.92 ALDH1A1 (0.50) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL364760 0.90 KDM4E (0.63) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL366407 0.87 KMT2A (0.48) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL364930 0.83 MAPT (0.51) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL365999 0.82 ALDH1A1 (0.48) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL365561 0.82 ALDH1A1 (0.47) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL366243 0.80 ALDH1A1 (0.58) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL365110 0.80 ALDH1A1 (0.53) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL365621 0.80 MAPT (0.53) ALDH1A1KDM4EKMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 — — WO disclosed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 — — WO disclosed
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