SCHEMBL30175553

SCHEMBL30175553

O=C(O)c1ccc(-c2oc3ccc(C(=O)O)cc3c(=O)c2O)cc1.[Zn]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.62
▸ KDM4E B2RXH2 5/20 0.62
▸ MEN1 O00255 5/20 0.62
▸ CYP3A4 P08684 5/20 0.62
▸ KMT2A Q03164 5/20 0.62
▸ HSD17B10 Q99714 4/20 0.62
▸ CYP2C9 P11712 2/20 0.62
▸ CSNK2A2 P19784 5/20 0.57
▸ CSNK2B P67870 5/20 0.57
▸ CSNK2A1 P68400 5/20 0.57
▸ CSNK2A3 Q8NEV1 2/20 0.57
▸ TTR P02766 4/20 0.55
▸ TP53 P04637 5/20 0.54
▸ MAPK1 P28482 3/20 0.54
▸ ALOX15 P16050 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ CA12 O43570 1/20 0.54
▸ CA1 P00915 1/20 0.54
▸ CA2 P00918 1/20 0.54
▸ ABCB1 P08183 1/20 0.54

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
SCHEMBL28424508 0.99 MAPT (0.64) MAPTKDM4EMEN1CYP3A4KMT2A
SCHEMBL6176954 0.91 KDM4E (0.68) MAPTKDM4EMEN1CYP3A4KMT2A
SCHEMBL25229668 0.86 CSNK2A2 (0.61) MAPTKDM4EMEN1CYP3A4KMT2A
SCHEMBL6176182 0.85 CSNK2A2 (0.55) MAPTKDM4EMEN1CYP3A4KMT2A
SCHEMBL17786624 0.82 MAPT (0.52) MAPTKDM4EMEN1CYP3A4KMT2A
SCHEMBL17940164 0.82 KDM4E (0.56) MAPTKDM4EMEN1CYP3A4KMT2A
SCHEMBL10887195 0.80 MEN1 (0.58) MAPTKDM4EMEN1CYP3A4KMT2A
SCHEMBL68189 0.78 TTR (0.83) MAPTKDM4EMEN1KMT2AHSD17B10
SCHEMBL11439145 0.78 TTR (0.59) MAPTKDM4EMEN1KMT2AHSD17B10
SCHEMBL8551049 0.77 CSNK2A2 (0.52) MAPTKDM4EMEN1CYP3A4KMT2A

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-111393460-B Zinc coordination compound of flavone derivative and preparation method and application thereof 鲁东大学 2023-01-17 — — CN disclosed
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