SCHEMBL5496071

SCHEMBL5496071

COc1ccc(C=Cc2ccc(C)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 2/20 1.00
ACHE P22303 1/20 0.71
TRPA1 O75762 1/20 0.68
CYP1A2 P05177 3/20 0.65
CYP1A1 P04798 3/20 0.65
CYP1B1 Q16678 3/20 0.65
PTGS2 P35354 3/20 0.65
ESR1 P03372 2/20 0.65
TUBB1 Q9H4B7 2/20 0.65
ALOX5 P09917 2/20 0.65
AHR P35869 2/20 0.65
ABL1 P00519 1/20 0.65
TTR P02766 1/20 0.65
ABCB1 P08183 1/20 0.65
BCR P11274 1/20 0.65
CYP19A1 P11511 1/20 0.65
NQO2 P16083 1/20 0.65
TUBB4A P04350 1/20 0.65
TUBB P07437 1/20 0.65
TUBA3C P0DPH7 1/20 0.65

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
SCHEMBL5496067 1.00 RELA (1.00) RELAACHETRPA1CYP1A2CYP1A1
SCHEMBL10097227 1.00 RELA (1.00) RELAACHETRPA1CYP1A2CYP1A1
SCHEMBL14947047 1.00 RELA (1.00) RELAACHETRPA1CYP1A2CYP1A1
SCHEMBL2622580 0.91 RELA (0.83) RELAACHETRPA1CYP1A2CYP1A1
SCHEMBL699458 0.90 RELA (0.81) RELATRPA1CYP1A2CYP1A1CYP1B1
SCHEMBL631998 0.90 RELA (0.81) RELATRPA1CYP1A2CYP1A1CYP1B1
SCHEMBL14950253 0.90 RELA (0.81) RELATRPA1CYP1A2CYP1A1CYP1B1
SCHEMBL4881152 0.90 RELA (0.81) RELATRPA1CYP1A2CYP1A1CYP1B1
SCHEMBL13790336 0.90 RELA (0.81) RELATRPA1CYP1A2CYP1A1CYP1B1
SCHEMBL699457 0.90 RELA (0.81) RELATRPA1CYP1A2CYP1A1CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8980954-B2 Substituted cis- and trans-stilbenes as therapeutic agents STC.UNM (US) 2015-03-17 US claimed
CN-114163313-B Method for selectively synthesizing EZ-stilbene by coupling ruthenium-catalyzed aryl diazonium salt with cinnamic acid 中山大学 2023-11-03 CN disclosed
CN-114163313-A Method for selectively synthesizing EZ-stilbene by coupling aryl diazonium salt and cinnamic acid under catalysis of ruthenium 中山大学 2022-03-11 CN disclosed
US-9925153-B2 Therapeutic agents for skin diseases and conditions STC.UNM (US) 2018-03-27 US disclosed
US-20160287531-A1 THERAPEUTIC AGENTS FOR SKIN DISEASES AND CONDITIONS STC.UNM 2016-10-06 US disclosed
WO-2015085143-A2 THERAPEUTIC AGENTS FOR SKIN DISEASES AND CONDITIONS STC.UNM (US) 2015-06-11 WO disclosed
US-8980954-B2 Substituted cis- and trans-stilbenes as therapeutic agents STC.UNM (US) 2015-03-17 US disclosed
US-20150034162-A1 DYE-SENSITIZED SOLAR CELL AND METHOD FOR MAKING SAME ADEKA CORPORATION (JP) 2015-02-05 US disclosed
US-20150034162-A1 DYE-SENSITIZED SOLAR CELL AND METHOD FOR MAKING SAME ADEKA CORPORATION (JP) 2015-02-05 US disclosed
US-8927685-B1 Thermoset and thermoplastic compositions derived from the essential oils of herbs THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2015-01-06 US disclosed
US-20130178536-A1 SUBSTITUTED CIS- AND TRANS-STILBENES AS THERAPEUTIC AGENTS STC.UNM (US) 2013-07-11 US disclosed
US-8383831-B2 Dye for dye-sensitized solar cell, semiconductor electrode, and dye-sensitized solar cell MITSUBISHI PAPER MILLS LIMITED (JP) 2013-02-26 US disclosed
US-8383831-B2 Dye for dye-sensitized solar cell, semiconductor electrode, and dye-sensitized solar cell MITSUBISHI PAPER MILLS LIMITED (JP) 2013-02-26 US disclosed
US-20110155241-A1 DYE FOR DYE-SENSITIZED SOLAR CELL, SEMICONDUCTOR ELECTRODE, AND DYE-SENSITIZED SOLAR CELL MITSUBISHI PAPER MILLS LIMITED (JP) 2011-06-30 US disclosed
US-20110155241-A1 DYE FOR DYE-SENSITIZED SOLAR CELL, SEMICONDUCTOR ELECTRODE, AND DYE-SENSITIZED SOLAR CELL MITSUBISHI PAPER MILLS LIMITED (JP) 2011-06-30 US disclosed
US-20070249647-A1 Substituted CIS- and trans-stilbenes as therapeutic agents REGENTS OF THE UNIVERSITY OF NEW MEXICO 2007-10-25 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 (4 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-20160287531-A1 THERAPEUTIC AGENTS FOR SKIN DISEASES AND CONDITIONS CUTA, TSLP, ELANE RELA 29/4885ACHE 1540/4885TRPA1 1457/4885
US-20070249647-A1 Substituted CIS- and trans-stilbenes as therapeutic agents TGFB1, VHL, TMSB10 RELA 12/4885ACHE 1869/4885TRPA1 1533/4885
US-20130178536-A1 SUBSTITUTED CIS- AND TRANS-STILBENES AS THERAPEUTIC AGENTS PSEN1, TERT, PSEN2 RELA 10/4885ACHE 47/4885TRPA1 1056/4885
US-20110155241-A1 DYE FOR DYE-SENSITIZED SOLAR CELL, SEMICONDUCTOR ELECTRODE, AND DYE-SENSITIZED SOLAR CELL CRY1, CRY2, TYR RELA 3244/4885ACHE 773/4885TRPA1 378/4885

“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.