SCHEMBL347877

SCHEMBL347877

COc1ccc(CC(=O)O)cc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 1.00
TSHR P16473 3/20 0.75
NFKB1 P19838 3/20 0.75
TDP1 Q9NUW8 2/20 0.75
ALDH1A1 P00352 1/20 0.75
LMNA P02545 2/20 0.61
APEX1 P27695 2/20 0.61
MAPT P10636 2/20 0.61
HPGD P15428 2/20 0.61
KDM4E B2RXH2 1/20 0.61
RGS12 O14924 1/20 0.61
POLB P06746 1/20 0.61
THPO P40225 1/20 0.61
BLM P54132 1/20 0.61
GNAI1 P63096 1/20 0.61
PMP22 Q01453 1/20 0.61
HIF1A Q16665 1/20 0.61
HSD17B10 Q99714 1/20 0.61
CA5A P35218 1/20 0.60
PTGS1 P23219 1/20 0.60

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
SCHEMBL29699330 1.00 GAA (1.00) GAATSHRNFKB1TDP1ALDH1A1
SCHEMBL30027889 0.88 GAA (0.79) GAATSHRNFKB1TDP1ALDH1A1
SCHEMBL31040284 0.88 GAA (0.79) GAATSHRNFKB1TDP1ALDH1A1
SCHEMBL8736645 0.86 GAA (0.76) GAATSHRNFKB1TDP1ALDH1A1
SCHEMBL18255551 0.86 GAA (0.75) GAATSHRNFKB1TDP1ALDH1A1
SCHEMBL30388881 0.86 GAA (0.75) GAATSHRNFKB1TDP1ALDH1A1
Homovanillic Acid SCHEMBL8792 0.86 GAA (1.00) GAATSHRNFKB1TDP1ALDH1A1
Homovanillic Acid SCHEMBL10535396 0.86 GAA (1.00) GAATSHRNFKB1TDP1ALDH1A1
Homovanillic Acid SCHEMBL30337229 0.86 GAA (1.00) GAATSHRNFKB1TDP1ALDH1A1
SCHEMBL153055 0.85 GAA (0.74) GAATSHRNFKB1TDP1ALDH1A1

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 526 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024194018-A1 METHOD FOR PRODUCING CORYTUBERINE AND SALUTARIDINE Universität Graz (AT) 2024-09-26 WO claimed
EP-4431612-A1 PROCESS FOR THE PREPARATION OF CORORYLOURIN AND SALUTARIDINE Universität Graz (AT) 2024-09-18 EP claimed
CN-109942593-B Total synthesis method of racemic tetrandrine 浙江金华康恩贝生物制药有限公司 2021-08-27 CN claimed
US-20210002226-A1 LEVORPHANOL PRODRUGS AND PROCESSES FOR MAKING AND USING THEM ALTER DOMUS (US) LLC 2021-01-07 US claimed
CN-110791003-A Crosslinked polyethylene cable insulating material and preparation method thereof 宋晓明 2020-02-14 CN claimed
CN-109942593-A A kind of total synthesis method of racemization hanfangchin A 浙江金华康恩贝生物制药有限公司 2019-06-28 CN claimed
US-20190085007-A1 4-methylcatechol Derivatives and Uses Thereof Thanares GmbH (DE) 2019-03-21 US claimed
WO-2018191472-A1 LEVORPHANOL PRODRUGS AND PROCESSES FOR MAKING AND USING THEM KEMPHARM, INC. (US) 2018-10-18 WO claimed
US-20170312270-A1 BENZOIC ACID, BENZOIC ACID DERIVATIVES AND HETEROARYL CARBOXYLIC ACID CONJUGATES OF OXYMORPHONE, PRODRUGS, METHODS OF MAKING AND USE THEREOF ALTER DOMUS (US) LLC 2017-11-02 US claimed
EP-3226907-A1 BENZOIC ACID, BENZOIC ACID DERIVATIVES AND HETEROARYL CARBOXYLIC ACID CONJUGATES OF OXYMORPHONE, PRODRUGS, METHODS AND MAKING AND USE THEREOF Kempharm, Inc. (US) 2017-10-11 EP claimed
US-20120142720-A1 Phenylethanoic Acid, Phenylpropanoic Acid and Phenylpropenoic Acid Conjugates and Prodrugs of Hydrocodone, Methods of Making and Use Thereof KEMPHARM, INC. (US) 2012-06-07 US claimed
EP-2448408-A1 PHENYLETHANOIC ACID, PHENYLPROPANOIC ACID AND PHENYLPROPENOIC ACID CONJUGATES AND PRODRUGS OF HYDROCODONE, METHODS OF MAKING AND USE THEREOF Kempharm, Inc. (US) 2012-05-09 EP claimed
US-20120016390-A1 BIOADHESIVE COMPOUNDS AND METHODS OF SYNTHESIS AND USE KNC NER ACQUISITION SUB, INC. (US) 2012-01-19 US claimed
WO-2012009664-A2 BIOADHESIVE COMPOUNDS AND METHODS OF SYNTHESIS AND USE KNC NER ACQUISITION SUB, INC. (US) 2012-01-19 WO claimed
WO-2011002995-A1 PHENYLETHANOIC ACID, PHENYLPROPANOIC ACID AND PHENYLPROPENOIC ACID CONJUGATES AND PRODRUGS OF HYDROCODONE, METHODS OF MAKING AND USE THEREOF KEMPHARM, INC. (US) 2011-01-06 WO claimed
US-20110002991-A1 PHENYLETHANOIC ACID, PHENYLPROPANOIC ACID AND PHENYLPROPENOIC ACID CONJUGATES AND PRODRUGS OF HYDROCODONE, METHOD OF MAKING AND USE THEREOF ALTER DOMUS (US) LLC 2011-01-06 US claimed
CN-1045442-C Levo- and dextro-rotary chloroscouriline (tetrahydroprotoberberines) and application thereof SHANGHAI INST OF MEDICINE CHIN (CN) 1999-10-06 CN claimed
CN-1115318-A Levo- and dextro-rotary chloroscouriline (tetrahydroprotoberberines) and application thereof SHANGHAI INST MATERIA MEDICA (CN) 1996-01-24 CN claimed
WO-1990009976-A1 METHOD OF SYNTHESIS OF HYDROXY-SUBSTITUTED-4-ALKOXYPHENYLACETIC ACIDS THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, UNITED STATES DEPARTMENT OF COMMERCE (US) 1990-09-07 WO claimed
US-4025553-A Production of o-hydroxybenzyl alcohols SHIONOGI & CO., LTD. (JA) 1977-05-24 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20120142720-A1 Phenylethanoic Acid, Phenylpropanoic Acid and Phenylpropenoic Acid Conjugates and Prodrugs of Hydrocodone, Methods of Making and Use Thereof CYP7A1, CYP2B6, CYP2D6 GAA 1112/4885TSHR 3473/4885NFKB1 2239/4885
US-20170312270-A1 BENZOIC ACID, BENZOIC ACID DERIVATIVES AND HETEROARYL CARBOXYLIC ACID CONJUGATES OF OXYMORPHONE, PRODRUGS, METHODS OF MAKING AND USE THEREOF OPRM1, OPRK1, OPRD1 GAA 2640/4885TSHR 1155/4885NFKB1 437/4885
US-20190085007-A1 4-methylcatechol Derivatives and Uses Thereof ST3GAL3, GALE, DPP4 GAA 330/4885TSHR 4840/4885NFKB1 2505/4885
US-20110002991-A1 PHENYLETHANOIC ACID, PHENYLPROPANOIC ACID AND PHENYLPROPENOIC ACID CONJUGATES AND PRODRUGS OF HYDROCODONE, METHOD OF MAKING AND USE THEREOF CYP7A1, CYP2B6, CYP2D6 GAA 1146/4885TSHR 3482/4885NFKB1 2203/4885
US-20210002226-A1 LEVORPHANOL PRODRUGS AND PROCESSES FOR MAKING AND USING THEM OPRM1, OPRK1, OPRD1 GAA 2449/4885TSHR 349/4885NFKB1 4553/4885

“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.