SCHEMBL367973

SCHEMBL367973

CC1(C)Oc2ccc(CCO)cc2O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.53
ALOX12 P18054 1/20 0.53
TSHR P16473 1/20 0.46
PTGS2 P35354 11/20 0.45
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ALOX5 P09917 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
BACE1 P56817 1/20 0.42
NPC1 O15118 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTGS1 P23219 1/20 0.39
XDH P47989 1/20 0.39
CA2 P00918 1/20 0.38

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
SCHEMBL31490194 1.00 ALOX15 (0.53) ALOX15ALOX12TSHRPTGS2KDM4E
SCHEMBL17662432 0.89 ALOX15 (0.50) ALOX15ALOX12TSHRPTGS2NPC1
SCHEMBL31009079 0.85 ALOX15 (0.55) ALOX15ALOX12TSHRPTGS2ALDH1A1
SCHEMBL25084169 0.85 ALOX15 (0.55) ALOX15ALOX12TSHRPTGS2ALDH1A1
SCHEMBL9589157 0.83 ALOX15 (0.50) ALOX15ALOX12TSHRPTGS2ALOX5
SCHEMBL25446354 0.83 KDM4E (0.44) ALOX15ALOX12PTGS2KDM4EALDH1A1
SCHEMBL22657669 0.81 CTNNB1 (0.43) PTGS2KDM4EALDH1A1ALOX5GAA
SCHEMBL11888425 0.81 TAAR1 (0.53) ALOX15ALOX12TSHRKDM4EALDH1A1
SCHEMBL9588857 0.80 ALOX15 (0.48) ALOX15ALOX12TSHRALDH1A1NPC1
SCHEMBL5346679 0.80 ALOX15 (0.48) ALOX15ALOX12TSHRNPC1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019171088-A1 BIOISPIRED PROTEASOME ACTIVATORS WITH ANTIAGEING ACTIVITY NATIONAL HELLENIC RESEARCH FOUNDATION (GR) 2019-09-12 WO disclosed
EP-2666761-A1 HYDROXYTYROSOL ETHERS Fundacio Imim (ES) 2013-11-27 EP disclosed
US-20130267588-A1 HYDROXYTYROSOL ETHERS FUNDACIO IMIM (ES) 2013-10-10 US disclosed
US-20130267588-A1 HYDROXYTYROSOL ETHERS FUNDACIO IMIM (ES) 2013-10-10 US disclosed
US-20130267588-A1 HYDROXYTYROSOL ETHERS FUNDACIO IMIM (ES) 2013-10-10 US disclosed
WO-2012080555-A1 HYDROXYTYROSOL ETHERS FUNDACIÓ IMIM (ES) 2012-06-21 WO disclosed
WO-2012006783-A1 PROCESS FOR PRODUCTION OF HYDROXYTYROSOL USING ORGANOMETALLIC COMPOUNDS LONZA LTD (CH) 2012-01-19 WO disclosed
US-5475024-A Useful in treating liver disease EISAI CO., LTD. (JP) 1995-12-12 US disclosed
US-5292901-A Benzodioxole derivatives EISAI CO., LTD. (JP) 1994-03-08 US disclosed
EP-0281098-B1 BENZODIOXOLE DERIVATIVES, COMPOSITIONS COMPRISING THE SAME, AND THE USE OF THE SAME FOR THE MANUFACTURE OF MEDICAMENTS Eisai Co., Ltd. (JP) 1992-11-25 EP disclosed
US-5110956-A Liver disorders EISAI CO., LTD. (JP) 1992-05-05 US disclosed
EP-0281098-A1 Benzodioxole derivatives, compositions comprising the same, and the use of the same for the manufacture of medicaments Eisai Co., Ltd. (JP) 1988-09-07 EP 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-20130267588-A1 HYDROXYTYROSOL ETHERS CNR1, CNR2, HCRTR1 ALOX15 92/4885ALOX12 87/4885TSHR 952/4885

“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.