SCHEMBL7785448

SCHEMBL7785448

C=CCc1ccc(O)c(-c2ccc(O)c(CCC)c2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 13/20 0.76
GABRB2 P47870 13/20 0.76
ALOX5 P09917 8/20 0.76
CNR2 P34972 6/20 0.76
CNR1 P21554 3/20 0.76
MEN1 O00255 2/20 0.76
GAA P10253 2/20 0.76
MAPT P10636 2/20 0.76
KMT2A Q03164 2/20 0.76
POLB P06746 1/20 0.76
GABRB1 P18505 1/20 0.76
RXRA P19793 1/20 0.76
GABRA5 P31644 1/20 0.76
GABRA3 P34903 1/20 0.76
GABRA2 P47869 1/20 0.76
ACE2 Q9BYF1 1/20 0.76
SIRT3 Q9NTG7 1/20 0.76
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 1/20 0.59
ALDH2 P05091 1/20 0.59

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
SCHEMBL7785437 0.89 GABRA1 (0.76) GABRA1GABRB2ALOX5CNR2CNR1
SCHEMBL29443445 0.89 GABRA1 (0.76) GABRA1GABRB2ALOX5CNR2CNR1
SCHEMBL18793822 0.89 GABRA1 (0.81) GABRA1GABRB2ALOX5CNR2CNR1
Honokiol SCHEMBL16011724 0.87 GABRA1 (1.00) GABRA1GABRB2ALOX5CNR2CNR1
Honokiol SCHEMBL29363985 0.87 GABRA1 (1.00) GABRA1GABRB2ALOX5CNR2CNR1
Honokiol SCHEMBL30008303 0.87 GABRA1 (1.00) GABRA1GABRB2ALOX5CNR2CNR1
Honokiol SCHEMBL29384099 0.87 GABRA1 (1.00) GABRA1GABRB2ALOX5CNR2CNR1
Honokiol SCHEMBL133034 0.87 GABRA1 (1.00) GABRA1GABRB2ALOX5CNR2CNR1
Magnolol SCHEMBL527731 0.85 GABRA1 (0.97) GABRA1GABRB2ALOX5CNR2CNR1
SCHEMBL12319404 0.85 ALOX5 (1.00) GABRA1GABRB2ALOX5CNR2CNR1

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-20130303788-A1 METHOD OF PRODUCING BIPHENOLIC COMPOUND, NOVEL BIPHENYL COMPOUND AND SYNTHESIS METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR TREATING PARKINSON'S DISEASE TZU CHI UNIVERSITY (TW) 2013-11-14 US claimed
EP-0991614-A1 SYNTHESIS OF DIHYDROHONOKIOL COMPOSITIONS Board of Regents, The University of Texas System (US) 2000-04-12 EP claimed
WO-1999000346-A1 SYNTHESIS OF DIHYDROHONOKIOL COMPOSITIONS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-01-07 WO claimed
EP-3364957-B1 IMPROVED SYNTHESIS OF HONOKIOL COLGATE PALMOLIVE CO (US) 2020-12-09 EP disclosed
WO-2017070568-A1 IMPROVED SYNTHESIS OF HONOKIOL COLGATE-PALMOLIVE COMPANY (US) 2017-04-27 WO disclosed
US-20170113989-A1 SYNTHESIS OF HONOKIOL COLGATE-PALMOLIVE COMPANY 2017-04-27 US disclosed
US-20170113989-A1 SYNTHESIS OF HONOKIOL COLGATE-PALMOLIVE COMPANY 2017-04-27 US disclosed
US-20130303788-A1 METHOD OF PRODUCING BIPHENOLIC COMPOUND, NOVEL BIPHENYL COMPOUND AND SYNTHESIS METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR TREATING PARKINSON'S DISEASE TZU CHI UNIVERSITY (TW) 2013-11-14 US disclosed
US-20080300298-A1 Honokiol Derivates For the Treatment of Proliferative Disorders NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-12-04 US disclosed
US-20080300298-A1 Honokiol Derivates For the Treatment of Proliferative Disorders NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-12-04 US disclosed
EP-1140756-A2 SYNTHESIS OF DIHYDROHONOKIOL COMPOSITIONS THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2001-10-10 EP disclosed
WO-2000040532-A2 SYNTHESIS OF DIHYDROHONOKIOL COMPOSITIONS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-07-13 WO disclosed
EP-0991614-A1 SYNTHESIS OF DIHYDROHONOKIOL COMPOSITIONS Board of Regents, The University of Texas System (US) 2000-04-12 EP disclosed
WO-1999036380-A1 ANXIOLYTIC AGENTS CONTAINING BIPHENYL DERIVATIVES AS THE ACTIVE INGREDIENT TSUMURA & CO. (JP) 1999-07-22 WO disclosed
WO-1999000346-A1 SYNTHESIS OF DIHYDROHONOKIOL COMPOSITIONS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-01-07 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 (3 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-20130303788-A1 METHOD OF PRODUCING BIPHENOLIC COMPOUND, NOVEL BIPHENYL COMPOUND AND SYNTHESIS METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR TREATING PARKINSON'S DISEASE PARK7, DBH, SNCA GABRA1 625/4885GABRB2 392/4885ALOX5 79/4885
US-20170113989-A1 SYNTHESIS OF HONOKIOL UGT2B7, UGT1A7, DHCR7 GABRA1 395/4885GABRB2 320/4885ALOX5 374/4885
US-20080300298-A1 Honokiol Derivates For the Treatment of Proliferative Disorders CCNK, CDK3, CCNO GABRA1 4042/4885GABRB2 4180/4885ALOX5 337/4885

“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.