SCHEMBL27379558

SCHEMBL27379558

C=C(O)c1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(C(=O)O)c(O)c3)cc2)cc1O

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.75
▸ PKM P14618 1/20 0.75
▸ SIRT6 Q8N6T7 2/20 0.62
▸ KDM4E B2RXH2 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ ALOX15 P16050 1/20 0.50
▸ PYGL P06737 2/20 0.48
▸ HPSE Q9Y251 2/20 0.47
▸ TOP1 P11387 1/20 0.46
▸ SNCA P37840 1/20 0.45
▸ NR1H4 Q96RI1 1/20 0.45
▸ EPHX2 P34913 1/20 0.45
▸ MITF O75030 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KCNK3 O14649 1/20 0.44
▸ KCNK9 Q9NPC2 1/20 0.44

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
SCHEMBL27296254 0.92 KMT2A (0.87) KMT2APKMSIRT6KDM4EMAPT
SCHEMBL30772317 0.92 KMT2A (0.87) KMT2APKMSIRT6KDM4EMAPT
Benzoylpas SCHEMBL563122 0.86 KMT2A (1.00) KMT2APKMSIRT6KDM4EMAPT
SCHEMBL7609498 0.85 KMT2A (0.75) KMT2APKMSIRT6KDM4EMAPT
Benzoylpas SCHEMBL8748163 0.84 KMT2A (0.97) KMT2APKMSIRT6KDM4EMAPT
Benzoylpas SCHEMBL29353120 0.84 KMT2A (0.97) KMT2APKMSIRT6KDM4EMAPT
Benzoylpas SCHEMBL9770542 0.84 KMT2A (0.97) KMT2APKMSIRT6KDM4EMAPT
SCHEMBL11998908 0.84 KMT2A (0.69) KMT2APKMSIRT6KDM4EMAPT
SCHEMBL3296397 0.84 KMT2A (0.83) KMT2APKMSIRT6KDM4EMAPT
SCHEMBL15903931 0.81 KMT2A (0.69) KMT2APKMSIRT6KDM4EMAPT

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
WO-2024039408-A1 METHODS OF PREPARING METAL-ORGANIC FRAMEWORK COMPOUNDS GENERAL ELECTRIC TECHNOLOGY GMBH (CH) 2024-02-22 — — WO disclosed
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