SCHEMBL28617495

SCHEMBL28617495

NC(=O)NC(C(=O)Nc1ccccc1C(=O)O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.48
▸ RECQL P46063 1/20 0.48
▸ KMT2A Q03164 7/20 0.47
▸ MAPT P10636 2/20 0.47
▸ CTSK P43235 1/20 0.47
▸ CFD P00746 1/20 0.46
▸ MEN1 O00255 5/20 0.45
▸ CA12 O43570 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ CA9 Q16790 2/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ PKM P14618 1/20 0.44
▸ POLB P06746 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
SCHEMBL28618843 0.86 KDM4E (0.56) KDM4EKMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL14856040 0.84 KMT2A (0.54) KDM4ERECQLKMT2AMAPTMEN1
SCHEMBL28920385 0.82 POLB (0.56) KMT2AMAPTMEN1NPC1ALDH1A1
SCHEMBL28619493 0.80 KDM4E (0.62) KDM4EKMT2AMAPTMEN1NPC1
SCHEMBL28920993 0.79 POLB (0.51) KDM4EKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL6326283 0.79 KMT2A (0.62) KDM4EKMT2AMAPTCTSKCFD
SCHEMBL1460781 0.79 CTSS (0.59) KDM4ERECQLCTSKCA12CA2
SCHEMBL1460777 0.79 CTSS (0.59) KDM4ERECQLCTSKCA12CA2
SCHEMBL5696465 0.75 LMNA (0.60) KDM4ERECQLKMT2AMAPTCFD
SCHEMBL5176882 0.75 KMT2A (0.52) KDM4ERECQLKMT2AMAPTCFD

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
CN-110041285-B Preparation method of 2, 4, 5-trisubstituted oxazole compound 大连理工大学 2021-08-20 — — CN disclosed
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