SCHEMBL18179855

SCHEMBL18179855

O=C(Cc1cc(OCc2ccccc2)cc(OCc2ccccc2)c1)OCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.69
MAPK1 P28482 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
PRKCA P17252 1/20 0.56
PRKCD Q05655 1/20 0.56
PAM P19021 1/20 0.53
LTB4R Q15722 2/20 0.52
LTB4R2 Q9NPC1 2/20 0.52
NR4A2 P43354 2/20 0.50
NR4A1 P22736 1/20 0.50
NR4A3 Q92570 1/20 0.50
MAOB P27338 2/20 0.48
PARP10 Q53GL7 1/20 0.47
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
PTGS1 P23219 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
SCHEMBL4852083 0.89 MEN1 (0.56) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL1137350 0.89 ALDH1A1 (0.67) ALDH1A1MAPK1L3MBTL1PRKCAPRKCD
SCHEMBL490786 0.86 MEN1 (0.59) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL20867886 0.85 ALDH1A1 (0.77) ALDH1A1MAPK1L3MBTL1PRKCAPRKCD
SCHEMBL2658123 0.85 ALDH1A1 (0.77) ALDH1A1MAPK1L3MBTL1PRKCAPRKCD
SCHEMBL28207459 0.85 ALDH1A1 (0.77) ALDH1A1MAPK1L3MBTL1PRKCAPRKCD
SCHEMBL9205647 0.85 MEN1 (0.67) MEN1KMT2ALTB4RLTB4R2NR4A2
SCHEMBL2957881 0.85 MEN1 (0.67) MEN1KMT2ALTB4RLTB4R2NR4A2
SCHEMBL16348239 0.83 MEN1 (0.65) MEN1KMT2ALTB4RLTB4R2NR4A2
SCHEMBL8051693 0.83 NR1H4 (0.51) ALDH1A1MAPK1L3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117396455-A Resorcinol, its manufacturing method and use 吉伟研究有限公司 2024-01-12 CN disclosed
WO-2022238707-A1 RESCORCINOLS, METHODS FOR THEIR MANUFACTURE, AND USES THEREOF GW Research Limited (GB) 2022-11-17 WO disclosed
US-10004722-B2 Method for treating hepatic encephalopathy or a disease associated with free radical mediate stress and oxidative stress with novel functionalized 1,3-benzene diols KANNALIFE SCIENCES, INC. (US) 2018-06-26 US disclosed
US-20170157097-A1 METHOD FOR TREATING HEPATIC ENCEPHALOPATHY OR A DISEASE ASSOCIATED WITH FREE RADICAL MEDIATE STRESS AND OXIDATIVE STRESS WITH NOVEL FUNCTIONALIZED 1,3-BENZENE DIOLS KANNALIFE SCIENCES, INC. 2017-06-08 US disclosed
US-9611213-B2 Functionalized 1,3-benzene diols and their method of use for the treatment of hepatic encephalopathy KANNALIFE SCIENCES, INC. (US) 2017-04-04 US disclosed
US-20160311769-A1 NOVEL FUNCTIONALIZED 1,3-BENZENE DIOLS AND THEIR METHOD OF USE FOR THE TREATMENT OF HEPATIC ENCEPHALOPTHY KANNALIFE SCIENCES, INC. 2016-10-27 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 (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-20170157097-A1 METHOD FOR TREATING HEPATIC ENCEPHALOPATHY OR A DISEASE ASSOCIATED WITH FREE RADICAL MEDIATE STRESS AND OXIDATIVE STRESS WITH NOVEL FUNCTIONALIZED 1,3-BENZENE DIOLS TXNRD2, KEAP1, GOT2 ALDH1A1 195/4885MAPK1 1444/4885L3MBTL1 3909/4885
US-20160311769-A1 NOVEL FUNCTIONALIZED 1,3-BENZENE DIOLS AND THEIR METHOD OF USE FOR THE TREATMENT OF HEPATIC ENCEPHALOPTHY EPHX1, DBH, EPHX2 ALDH1A1 197/4885MAPK1 3104/4885L3MBTL1 3561/4885
US-10004722-B2 Method for treating hepatic encephalopathy or a disease associated with free radical mediate stress and oxidative stress with novel functionalized 1,3-benzene diols TXNRD2, KEAP1, GOT2 ALDH1A1 195/4885MAPK1 1444/4885L3MBTL1 3909/4885

“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.