SCHEMBL20535657

SCHEMBL20535657

N#CCN1C(=O)c2ccc(NC(=O)c3ccc(-c4cc(O)cc(O)c4)cc3)cc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ ALDH1A1 P00352 4/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ RECQL P46063 1/20 0.45
▸ POLB P06746 4/20 0.44
▸ RPS6KA2 Q15349 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ RAB9A P51151 4/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ GFER P55789 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ ACHE P22303 1/20 0.41

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
SCHEMBL20534830 0.91 MEN1 (0.49) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20535005 0.88 ALDH1A1 (0.45) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20535061 0.85 ALDH1A1 (0.46) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20535270 0.84 ALDH1A1 (0.48) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20535272 0.84 TP53 (0.49) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20535966 0.84 MAPT (0.55) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20535063 0.77 ALDH1A1 (0.53) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20534979 0.77 ALDH1A1 (0.61) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20535157 0.73 ALDH1A1 (0.60) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL20534827 0.73 RAB9A (0.69) MEN1KMT2AALDH1A1KDM4EHPGD

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-2018189679-A1 ISOINDOLINE DERIVATIVES FOR USE AS AMPK ACTIVATORS UNIVERSITA' DI PISA (IT) 2018-10-18 — — WO claimed
WO-2018189679-A1 ISOINDOLINE DERIVATIVES FOR USE AS AMPK ACTIVATORS UNIVERSITA' DI PISA (IT) 2018-10-18 — — WO disclosed
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