SCHEMBL31424112

SCHEMBL31424112

Cc1ccc(O)c(-c2oc3cc(O)cc(O)c3c(=O)c2O)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.70
▸ MEN1 O00255 8/20 0.69
▸ KMT2A Q03164 8/20 0.69
▸ XDH P47989 7/20 0.69
▸ CYP3A4 P08684 6/20 0.69
▸ CYP2C9 P11712 6/20 0.69
▸ FTO Q9C0B1 6/20 0.69
▸ KDM4E B2RXH2 5/20 0.69
▸ ALOX15 P16050 5/20 0.69
▸ HSD17B10 Q99714 5/20 0.69
▸ MAPT P10636 5/20 0.69
▸ TP53 P04637 4/20 0.69
▸ ALDH1A1 P00352 4/20 0.69
▸ HPGD P15428 4/20 0.69
▸ CSNK2A2 P19784 4/20 0.69
▸ DAPK1 P53355 4/20 0.69
▸ BACE1 P56817 4/20 0.69
▸ CSNK2B P67870 4/20 0.69
▸ CSNK2A1 P68400 4/20 0.69
▸ GLO1 Q04760 4/20 0.69

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
SCHEMBL14008303 0.91 MEN1 (0.78) APPMEN1KMT2AXDHCYP3A4
SCHEMBL8042944 0.86 ABCB1 (0.81) APPMEN1KMT2AXDHCYP3A4
SCHEMBL10716775 0.83 MEN1 (0.79) APPMEN1KMT2AXDHCYP3A4
SCHEMBL22738241 0.83 MEN1 (0.78) APPMEN1KMT2AXDHCYP3A4
Datiscetin SCHEMBL30822630 0.82 APP (1.00) APPMEN1KMT2AXDHCYP3A4
Datiscetin SCHEMBL29737517 0.82 APP (1.00) APPMEN1KMT2AXDHCYP3A4
Datiscetin SCHEMBL43916 0.82 APP (1.00) APPMEN1KMT2AXDHCYP3A4
Morin SCHEMBL29929115 0.82 MEN1 (1.00) APPMEN1KMT2AXDHCYP3A4
Morin SCHEMBL10335390 0.82 MEN1 (1.00) APPMEN1KMT2AXDHCYP3A4
Morin SCHEMBL29435805 0.82 MEN1 (1.00) APPMEN1KMT2AXDHCYP3A4

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-115840019-B Quality detection method for blumea balsamifera medicinal material 贵州百灵企业集团制药股份有限公司 2025-01-07 — — CN disclosed
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