SCHEMBL10030786

SCHEMBL10030786

COc1ccc(/C=C\c2cc(CO)c(CO)c(OC)c2)cc1N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB1 Q9H4B7 10/20 0.61
▸ TUBB4A P04350 5/20 0.61
▸ TUBB P07437 5/20 0.61
▸ TUBA3C P0DPH7 5/20 0.61
▸ TUBA1B P68363 5/20 0.61
▸ TUBA4A P68366 5/20 0.61
▸ TUBB4B P68371 5/20 0.61
▸ TUBB3 Q13509 5/20 0.61
▸ TUBB2A Q13885 5/20 0.61
▸ TUBB8 Q3ZCM7 5/20 0.61
▸ TUBA3E Q6PEY2 5/20 0.61
▸ TUBA1A Q71U36 5/20 0.61
▸ TUBA1C Q9BQE3 5/20 0.61
▸ TUBB6 Q9BUF5 5/20 0.61
▸ TUBB2B Q9BVA1 5/20 0.61
▸ APP P05067 4/20 0.56
▸ CYP1A1 P04798 2/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ PTGS2 P35354 1/20 0.47
▸ CYP19A1 P11511 1/20 0.47

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
SCHEMBL12593827 1.00 TUBB1 (0.61) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL17145723 0.94 TUBB1 (0.60) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10030791 0.91 TUBB1 (0.51) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL13456507 0.90 APP (0.57) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL12774239 0.90 TUBB1 (0.63) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL13223387 0.89 TUBB1 (0.49) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL13223338 0.87 TUBB1 (0.47) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL14192136 0.86 TUBB1 (0.74) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL17145750 0.86 TUBB1 (0.49) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL12774233 0.85 TUBB1 (0.50) TUBB1TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE45720-E1 Functionalized stilbene derivatives as improved vascular targeting agents OXIGENE, INC. (US) 2015-10-06 — — US disclosed
EP-2562154-A1 Method for preparing combretastatin SANOFI (FR) 2013-02-27 — — EP disclosed
US-20120046492-A1 Ethoxy Diphenyl Ethane Derivatives, Preparation Processes and Uses Thereof Zhejiang Wild Wind Pharmaceutical Co., Ltd. (CN) 2012-02-23 — — US disclosed
EP-2354118-A1 Process for the preparation of combretastatine Aventis Pharma S.A. (FR) 2011-08-10 — — EP disclosed
EP-2348012-A1 PROCESS FOR THE PREPARATION OF COMBRETASTATINE Aventis Pharma S.A. (FR) 2011-07-27 — — EP disclosed
US-7973076-B2 Anti-tumor composition AJINOMOTO CO., INC. (JP) 2011-07-05 — — US disclosed
US-20110054035-A1 Combination Comprising Combretastatin and Anticancer Agents AVENTIS PHARMA S.A. (FR) 2011-03-03 — — US disclosed
US-20110054035-A1 Combination Comprising Combretastatin and Anticancer Agents AVENTIS PHARMA S.A. (FR) 2011-03-03 — — US disclosed
US-7851443-B2 Combination comprising combretastatin and anticancer agents AVENTIS PHARMA SA (FR) 2010-12-14 — — US disclosed
US-20100069486-A1 ANTI-TUMOR COMPOSITION AJINOMOTO CO., INC. (JP) 2010-03-18 — — US disclosed
US-7655696-B2 Highly efficacious and highly safe composition of a Stilbene derivative and a platinum coordination compound cis-diaminedichloroplatinum (II) AJINOMOTO CO., INC. (JP) 2010-02-02 — — US disclosed
WO-2009118474-A1 METHOD FOR PREPARING COMBRETASTATIN SANOFI-AVENTIS (FR) 2009-10-01 — — WO disclosed
US-20090093540-A1 ANTI-TUMOR COMPOSITION AJINOMOTO CO., INC. (JP) 2009-04-09 — — US disclosed
US-20090023656-A1 Combination Comprising Combretastatin and Anticancer Agents AVENTIS PHARMA S.A. (FR) 2009-01-22 — — US disclosed
US-20070149476-A1 Combination Comprising Combretastatin and Anticancer Agents AVENTIS PHARMA S.A. (FR) 2007-06-28 — — US 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 (6 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-20070149476-A1 Combination Comprising Combretastatin and Anticancer Agents TOP1, TOP2A, TOP2B TUBB1 110/4885TUBB4A 112/4885TUBB 106/4885
US-20090023656-A1 Combination Comprising Combretastatin and Anticancer Agents TEK, FLT4, FLT1 TUBB1 47/4885TUBB4A 76/4885TUBB 46/4885
US-20100069486-A1 ANTI-TUMOR COMPOSITION TP53, VHL, MKI67 TUBB1 129/4885TUBB4A 194/4885TUBB 195/4885
US-20110054035-A1 Combination Comprising Combretastatin and Anticancer Agents TEK, FLT4, FLT1 TUBB1 47/4885TUBB4A 76/4885TUBB 46/4885
US-20090093540-A1 ANTI-TUMOR COMPOSITION TP53, VHL, MKI67 TUBB1 191/4885TUBB4A 291/4885TUBB 293/4885
US-20120046492-A1 Ethoxy Diphenyl Ethane Derivatives, Preparation Processes and Uses Thereof TUBB1, TUBB, TUBB3 TUBB1 1/4885TUBB4A 6/4885TUBB 2/4885

“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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