SCHEMBL3834841

SCHEMBL3834841

COc1ccc(/C=C\c2cc(OC)c(OC)c(OC)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 15/20 1.00
TUBB4A P04350 14/20 1.00
TUBB P07437 14/20 1.00
TUBA3C P0DPH7 14/20 1.00
TUBA1B P68363 14/20 1.00
TUBA4A P68366 14/20 1.00
TUBB4B P68371 14/20 1.00
TUBB3 Q13509 14/20 1.00
TUBB2A Q13885 14/20 1.00
TUBB8 Q3ZCM7 14/20 1.00
TUBA3E Q6PEY2 14/20 1.00
TUBA1A Q71U36 14/20 1.00
TUBA1C Q9BQE3 14/20 1.00
TUBB6 Q9BUF5 14/20 1.00
TUBB2B Q9BVA1 14/20 1.00
CYP1A1 P04798 3/20 0.72
CYP1A2 P05177 3/20 0.72
CYP1B1 Q16678 3/20 0.72
CYP19A1 P11511 1/20 0.71
NQO2 P16083 1/20 0.71

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
SCHEMBL1394056 1.00 TUBB1 (1.00) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1394054 1.00 TUBB1 (1.00) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2622579 0.93 TUBB1 (0.86) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL6896671 0.92 TUBB1 (0.85) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL631213 0.92 TUBB1 (0.85) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4659251 0.92 TUBB1 (0.85) TUBB1TUBB4ATUBBTUBA3CTUBA1B
Phosphoric Acid SCHEMBL5071958 0.90 TUBB1 (0.81) TUBB1TUBB4ATUBBTUBA3CTUBA1B
Sulfamate SCHEMBL21980870 0.89 TUBB1 (0.79) TUBB1TUBB4ATUBBTUBA3CTUBA1B
Sulfamate SCHEMBL21980862 0.89 TUBB1 (0.79) TUBB1TUBB4ATUBBTUBA3CTUBA1B
Sulfamate SCHEMBL21980873 0.89 TUBB1 (0.79) 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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9597299-B2 Method for treating gefitinib-resistant non-small-cell lung cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (MO) 2017-03-21 US claimed
US-20160158163-A1 Method For Treating Gefitinib-Resistant Non-Small-Cell Lung Cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-06-09 US claimed
US-5430062-A Combretastatin analogues; inhibition of tubulin polymerization and colchicine binding; antitumor,-mitotic and -neoplastic agents RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1995-07-04 US claimed
US-9597299-B2 Method for treating gefitinib-resistant non-small-cell lung cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (MO) 2017-03-21 US disclosed
US-9597299-B2 Method for treating gefitinib-resistant non-small-cell lung cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (MO) 2017-03-21 US disclosed
US-20160158163-A1 Method For Treating Gefitinib-Resistant Non-Small-Cell Lung Cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-06-09 US disclosed
US-20160158163-A1 Method For Treating Gefitinib-Resistant Non-Small-Cell Lung Cancer MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-06-09 US disclosed
EP-2065358-B1 THE PREPARTION AND THE USE OF ETHOXY COMBRETASTATINS AND THEIR PRODRUGS ZHEJIANG DADE PHARMACEUTICAL GROUP CO LTD (CN) 2015-07-08 EP disclosed
EP-1248774-B1 POLYHYDROXYSTILBENES AND STILBENE OXIDES AS ANTIPSORIATIC AGENTS AND PROTEIN KINASE INHIBITORS WELICHEM BIOTECH INC (CA) 2009-10-07 EP disclosed
US-6943194-B1 Synthesis of phenstatin and prodrugs thereof ARIZONA BOARD OF REGENTS, ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2005-09-13 US disclosed
US-6677383-B1 SUPRRESION OF TUMORS CONTAINING OXIDOREDUCTASE ENZYMES, BY CONTACTING THE CELLS WITH ANTITUMOR CHEMICAL INTERMEDIATES SUCH AS 3,4,5-TRIMETHOXY-4'-METHOXYSTILBENE DE MONTFORT UNIVERSITY (GB) 2004-01-13 US disclosed
WO-1999034788-A1 SYNTHESIS OF PHENSTATIN AND PRODRUGS THEREOF ARIZONA BOARD OF REGENTS, A BODY CORPORATE, ACTING ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 1999-07-15 WO disclosed
EP-0754682-A1 AMINOSTILBAZOLE DERIVATIVE AND MEDICINE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1997-01-22 EP disclosed
US-5430062-A Combretastatin analogues; inhibition of tubulin polymerization and colchicine binding; antitumor,-mitotic and -neoplastic agents RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1995-07-04 US disclosed
US-5430062-A Combretastatin analogues; inhibition of tubulin polymerization and colchicine binding; antitumor,-mitotic and -neoplastic agents RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1995-07-04 US disclosed
EP-0641301-A1 STILBENE DERIVATIVES AS ANTICANCER AGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1995-03-08 EP disclosed
EP-0641301-A1 STILBENE DERIVATIVES AS ANTICANCER AGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1995-03-08 EP disclosed
WO-1993023357-B1 STILBENE DERIVATIVES AS ANTICANCER AGENTS 1994-01-06 WO disclosed
WO-1993023357-A1 STILBENE DERIVATIVES AS ANTICANCER AGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-11-25 WO disclosed
WO-1993023357-A1 STILBENE DERIVATIVES AS ANTICANCER AGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-11-25 WO disclosed