SCHEMBL7043643

SCHEMBL7043643

CC#COc1ccc2c(=O)cc(-c3ccccc3)oc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 3/20 0.69
▸ TNKS O95271 3/20 0.69
▸ CYP3A4 P08684 6/20 0.64
▸ SMN1; SMN2 Q16637 4/20 0.64
▸ TP53 P04637 4/20 0.64
▸ MAPT P10636 3/20 0.64
▸ LMNA P02545 2/20 0.64
▸ MEN1 O00255 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ SIGMAR1 Q99720 1/20 0.58
▸ MAOB P27338 6/20 0.57
▸ ABCB1 P08183 3/20 0.57
▸ CA12 O43570 2/20 0.57
▸ CA1 P00915 2/20 0.57
▸ CA2 P00918 2/20 0.57
▸ CYP1B1 Q16678 2/20 0.57
▸ CA9 Q16790 2/20 0.57
▸ AKR1B10 O60218 1/20 0.57
▸ CYP1A2 P05177 1/20 0.57
▸ CALM1 P0DP23 1/20 0.57

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
7-Methoxyflavone SCHEMBL1373009 0.82 TNKS (1.00) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL7044787 0.79 ALDH1A1 (0.60) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL27493025 0.78 SMN1; SMN2 (1.00) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL9140701 0.78 KDM4E (0.74) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL30540840 0.78 SMN1; SMN2 (1.00) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL4172232 0.77 MAPT (0.74) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL27889513 0.77 CYP19A1 (0.70) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL7046410 0.77 MAOA (0.67) CYP3A4SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL10025659 0.76 SIGMAR1 (0.76) CYP19A1TNKSCYP3A4SMN1; SMN2TP53
SCHEMBL7933562 0.76 CYP3A4 (0.81) CYP19A1TNKSCYP3A4SMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6608089-B2 Having antiproliferative activity and are useful as modulators of multiple drug resistance in cancer chemotherapy of neoplasms, for use in manufacture of medicament for menopausal disorders and osteoporosis INDENA S.P.A. (IT) 2003-08-19 — — US disclosed
EP-1212312-B1 NOVEL DERIVATIVES OF FLAVONES, XANTHONES AND COUMARINS INDENA SPA (IT) 2003-04-02 — — EP disclosed
US-20020183318-A1 Having antiproliferative activity and are useful as modulators of multiple drug resistance in cancer chemotherapy of neoplasms, for use in manufacture of medicament for menopausal disorders and osteoporosis INDENA S.P.A. (IT) 2002-12-05 — — US disclosed
EP-1212312-A1 NOVEL DERIVATIVES OF FLAVONES, XANTHONES AND COUMARINS INDENA S.p.A. (IT) 2002-06-12 — — EP disclosed
WO-2001017985-A1 NOVEL DERIVATIVES OF FLAVONES, XANTHONES AND COUMARINS INDENA S.P.A. (IT) 2001-03-15 — — 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-20020183318-A1 Having antiproliferative activity and are useful as modulators of multiple drug resistance in cancer chemotherapy of neoplasms, for use in manufacture of medicament for menopausal disorders and osteoporosis BRCA1, NCEH1, EZH1 CYP19A1 35/4885TNKS 3337/4885CYP3A4 3331/4885

“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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