SCHEMBL1144215

SCHEMBL1144215

CC(=O)OCOc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 6/20 0.69
▸ MEN1 O00255 5/20 0.69
▸ KMT2A Q03164 5/20 0.69
▸ CYP1A1 P04798 5/20 0.69
▸ CYP1B1 Q16678 5/20 0.69
▸ CA12 O43570 3/20 0.69
▸ CA2 P00918 3/20 0.69
▸ PPARG P37231 3/20 0.69
▸ CA7 P43166 3/20 0.69
▸ XDH P47989 3/20 0.69
▸ IPMK Q8NFU5 3/20 0.69
▸ IP6K2 Q9UHH9 3/20 0.69
▸ CA4 P22748 2/20 0.69
▸ BCL9 O00512 13/20 0.66
▸ CTNNB1 P35222 13/20 0.66
▸ KDM4E B2RXH2 3/20 0.61
▸ TP53 P04637 3/20 0.61
▸ CYP3A4 P08684 3/20 0.61
▸ CYP2C9 P11712 3/20 0.61
▸ ALOX15 P16050 3/20 0.61

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
SCHEMBL18102793 0.90 MEN1 (0.76) CYP1A2MEN1KMT2ACYP1A1CYP1B1
SCHEMBL1144649 0.89 MEN1 (0.66) CYP1A2MEN1KMT2ACYP1A1CYP1B1
SCHEMBL1144392 0.89 BCL9 (0.66) CYP1A2MEN1KMT2ACYP1A1CYP1B1
SCHEMBL21833977 0.84 BCL9 (0.76) CYP1A2MEN1KMT2ACYP1A1CYP1B1
SCHEMBL3647365 0.83 CYP1A2 (0.72) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Quercetin SCHEMBL4468031 0.83 MEN1 (0.74) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL19235 0.82 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL30385934 0.82 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL29377152 0.82 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL29390102 0.82 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034413-A1 NOVEL QUERCETIN DERIVATIVES AS ANTI-CANCER AGENTS DABUR PHARMA LIMITED (IN) 2011-02-10 — — US disclosed
US-20110034413-A1 NOVEL QUERCETIN DERIVATIVES AS ANTI-CANCER AGENTS DABUR PHARMA LIMITED (IN) 2011-02-10 — — US disclosed
US-20110034413-A1 NOVEL QUERCETIN DERIVATIVES AS ANTI-CANCER AGENTS DABUR PHARMA LIMITED (IN) 2011-02-10 — — US disclosed
WO-2009019721-A2 QUERCETIN DERIVATIVES AS ANTI-CANCER AGENTS DABUR PHARMA LIMITED (IN) 2009-02-12 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110034413-A1 NOVEL QUERCETIN DERIVATIVES AS ANTI-CANCER AGENTS TP53, ABCG2, RELA CYP1A2 580/4885MEN1 1405/4885KMT2A 2019/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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