SCHEMBL28906161

SCHEMBL28906161

O=CC(=NNc1ccccc1)c1ccccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.46
▸ MEN1 O00255 5/20 0.46
▸ KMT2A Q03164 5/20 0.46
▸ HPGD P15428 5/20 0.46
▸ HTT P42858 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ GAA P10253 6/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ MAPT P10636 5/20 0.44
▸ GFER P55789 1/20 0.44
▸ POLB P06746 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ HMGB1 P09429 1/20 0.41
▸ CA4 P22748 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
SCHEMBL3277615 0.79 ALDH1A1 (0.45) KDM4EMEN1KMT2AHPGDHTT
SCHEMBL21283631 0.79 ALDH1A1 (0.45) KDM4EMEN1KMT2AHPGDHTT
SCHEMBL16266285 0.74 MAPT (0.61) KDM4EMEN1KMT2AHPGDTP53
SCHEMBL11752824 0.69 GFER (0.46) KDM4EMEN1KMT2AHPGDHTT
SCHEMBL9883332 0.69 CA1 (0.41) KDM4EMEN1KMT2AHPGDHTT
SCHEMBL14294535 0.69 CA1 (0.41) KDM4EMEN1KMT2AHPGDHTT
SCHEMBL6925984 0.67 GAA (0.38) KDM4EMEN1KMT2AHPGDHTT
SCHEMBL23384578 0.66 NPSR1 (0.49) KDM4EMEN1KMT2AHPGDHTT
SCHEMBL10736348 0.66 GAA (0.43) KDM4EMEN1KMT2AHTTLMNA
SCHEMBL10736360 0.66 GAA (0.43) KDM4EMEN1KMT2AHTTLMNA

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
CN-115109006-B Preparation method of 3-substituted-1, 2-benzoxazine-4-ketone compound 上海大学 2025-03-14 — — CN disclosed
CN-115109006-A 3-substituted-1, 2-benzoxazine-4-ketone compound and preparation method thereof 上海大学 2022-09-27 — — CN disclosed
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