SCHEMBL3189987

SCHEMBL3189987

O=c1cc(-c2ccc(Cl)cc2)oc2cc(O)cc(O)c12

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.81
▸ ALDH1A1 P00352 7/20 0.81
▸ KMT2A Q03164 7/20 0.81
▸ CYP1B1 Q16678 7/20 0.81
▸ ABCB1 P08183 6/20 0.81
▸ MAPT P10636 6/20 0.81
▸ CYP1A1 P04798 6/20 0.81
▸ CYP1A2 P05177 6/20 0.81
▸ CYP3A4 P08684 5/20 0.81
▸ HPGD P15428 5/20 0.81
▸ POLH Q9Y253 5/20 0.81
▸ TP53 P04637 4/20 0.81
▸ CYP2D6 P10635 4/20 0.81
▸ CYP2C9 P11712 4/20 0.81
▸ MAOA P21397 4/20 0.81
▸ MAOB P27338 4/20 0.81
▸ CYP2C19 P33261 4/20 0.81
▸ SMN1; SMN2 Q16637 4/20 0.81
▸ HIF1A Q16665 4/20 0.81
▸ KDM4E B2RXH2 4/20 0.81

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
Apigenin SCHEMBL19428 0.89 KMT2A (1.00) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL5083245 0.89 KMT2A (1.00) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL29351464 0.89 KMT2A (1.00) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL29968480 0.88 KMT2A (0.97) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL1658882 0.88 KMT2A (0.97) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL29872582 0.88 KMT2A (0.97) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL31477961 0.88 KMT2A (0.97) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL29458838 0.88 KMT2A (0.97) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL30544810 0.88 KMT2A (0.97) MEN1ALDH1A1KMT2ACYP1B1ABCB1
Apigenin SCHEMBL31168790 0.88 KMT2A (0.97) MEN1ALDH1A1KMT2ACYP1B1ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103965173-A Compounds and methods for treating estrogen receptor-related disorders HENOGEN PHARMA GROUP LTD 2014-08-06 — — CN disclosed
CN-103965172-A Compounds and methods for treating estrogen receptor-related disorders SHENOGEN PHARMA GROUP LTD 2014-08-06 — — CN disclosed
CN-102018698-B Compounds and methods for treating estrogen receptor-related disorders SHENOGEN PHARMA GROUP LTD 2014-07-02 — — CN disclosed
CN-103755673-A Compounds and methods for treating estrogen receptor-related disorders SHENOGEN PHARMA GROUP LTD 2014-04-30 — — CN disclosed
EP-2262366-A1 COMPOUNDS AND METHODS FOR TREATING ESTROGEN RECEPTOR-RELATED DISEASES Shenogen Pharma Group Ltd. (CN) 2010-12-22 — — EP disclosed
US-20100016352-A1 COMPOUNDS AND METHODS FOR TREATING ESTROGEN RECEPTOR-RELATED DISEASES SHENOGEN PHARMA GROUP LTD. (CN) 2010-01-21 — — US disclosed
US-20100016352-A1 COMPOUNDS AND METHODS FOR TREATING ESTROGEN RECEPTOR-RELATED DISEASES SHENOGEN PHARMA GROUP LTD. (CN) 2010-01-21 — — US disclosed
US-20100016352-A1 COMPOUNDS AND METHODS FOR TREATING ESTROGEN RECEPTOR-RELATED DISEASES SHENOGEN PHARMA GROUP LTD. (CN) 2010-01-21 — — US disclosed
WO-2009129372-A1 COMPOUNDS AND METHODS FOR TREATING ESTROGEN RECEPTOR-RELATED DISEASES SHENOGEN PHARMA GROUP LTD. (CN) 2009-10-22 — — 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-20100016352-A1 COMPOUNDS AND METHODS FOR TREATING ESTROGEN RECEPTOR-RELATED DISEASES ESR2, ESR1, ESRRB MEN1 3679/4885ALDH1A1 1811/4885KMT2A 2687/4885

“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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