Catechol

Catechol

SCHEMBL2241272

Oc1ccccc1O.[O]O

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.83
HPGD P15428 6/20 0.83
CA2 P00918 5/20 0.83
KDM4E B2RXH2 5/20 0.83
HSD17B10 Q99714 4/20 0.83
ALOX15 P16050 3/20 0.83
LMNA P02545 3/20 0.83
CA4 P22748 3/20 0.83
SMN1; SMN2 Q16637 3/20 0.83
CA12 O43570 3/20 0.83
MAPT P10636 3/20 0.83
CA14 Q9ULX7 3/20 0.83
EGFR P00533 2/20 0.83
FYN P06241 2/20 0.83
MMP9 P14780 2/20 0.83
RECQL P46063 2/20 0.83
TDP1 Q9NUW8 2/20 0.83
NPC1 O15118 2/20 0.83
GMNN O75496 1/20 0.83
POLB P06746 1/20 0.83

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
Catechol SCHEMBL30088487 0.91
Catechol SCHEMBL30944695 0.91 ALDH1A1 (1.00) ALDH1A1HPGDCA2KDM4EHSD17B10
Catechol SCHEMBL29352716 0.91
Catechol SCHEMBL11672589 0.91 ALDH1A1 (1.00) ALDH1A1HPGDCA2KDM4EHSD17B10
Catechol SCHEMBL367675 0.91 ALDH1A1 (1.00) ALDH1A1HPGDCA2KDM4EHSD17B10
Catechol SCHEMBL18351 0.91
Catechol SCHEMBL7871860 0.88 ALDH1A1 (0.77) ALDH1A1HPGDCA2KDM4EHSD17B10
Catechol SCHEMBL25313512 0.87
Catechol SCHEMBL20597824 0.87
Catechol SCHEMBL3294538 0.87

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-20160045486-A1 DOPAMINE RECEPTOR LIGANDS WITH ENHANCED DURATION OF ACTION THE PENN STATE RESEARCH FOUNDATION 2016-02-18 US disclosed
EP-2364317-A2 DOPAMINE RECEPTOR LIGANDS WITH ENHANCED DURATION OF ACTION Effipharma, Inc. (US) 2011-09-14 EP disclosed
US-20110190332-A1 DOPAMINE RECEPTOR LIGANDS WITH ENHANCED DURATION OF ACTION EFFIPHARMA (US) 2011-08-04 US disclosed
WO-2010017093-A2 DOPAMINE RECEPTOR LIGANDS WITH ENHANCED DURATION OF ACTION EFFIPHARMA, INC. (US) 2010-02-11 WO disclosed
EP-0777655-B1 PROCESS FOR PREPARING CHIRAL TETRACYCLIC DOPAMINERGIC COMPOUNDS ABBOTT LAB (US) 2001-01-10 EP disclosed
US-5659037-A FROM VERATROL DERIVATIVE CHIRAL STARTING MATERIAL USING SERIES OF CHIRAL-PRESERVING REACTIONS ABBOTT LABORATORIES (US) 1997-08-19 US disclosed
EP-0777655-A1 PROCESS FOR PREPARING CHIRAL TETRACYCLIC DOPAMINERGIC COMPOUNDS Abbott Laboratories (US) 1997-06-11 EP disclosed
US-5621133-A PREPARING A 1-(3,4-DIALKOXYPHENYL),3-HYDROXYALKANE(C6-C12) BY EPOXIDIZING A HALO DERIVATIVE WITH A BASE FOLLOWED BY DECYCLICIZING WITH AN ORGANOMETALLIC COMPOUND IN A SOLVENT; NAPHTHYLENES, ISOCHROMENES AND ISOTHIOCHROMENES DENINNO MICHAEL P (US) 1997-04-15 US disclosed
US-5591884-A PROTECTED HYDROXYALKYLCATECHOL INTERMEDIATES ABBOTT LABORATORIES (US) 1997-01-07 US disclosed
WO-1996038435-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1996-12-05 WO disclosed
WO-1996006085-A1 PROCESS FOR PREPARING CHIRAL TETRACYCLIC DOPAMINERGIC COMPOUNDS ABBOTT LABORATORIES (US) 1996-02-29 WO disclosed
EP-0474767-B1 DOPAMINE AGONISTS ABBOTT LAB (US) 1996-02-21 EP disclosed
EP-0474767-A4 DOPAMINE AGONISTS 1992-07-08 EP disclosed
EP-0474767-A1 DOPAMINE AGONISTS. ABBOTT LAB (US) 1992-03-18 EP disclosed
US-4994486-A Neurological disorders ABBOTT LABORATORIES (US) 1991-02-19 US disclosed
WO-1990015056-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1990-12-13 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 (2 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-20110190332-A1 DOPAMINE RECEPTOR LIGANDS WITH ENHANCED DURATION OF ACTION PRLHR, OPRD1, SLC6A3 ALDH1A1 1298/4885HPGD 1391/4885CA2 4649/4885
US-20160045486-A1 DOPAMINE RECEPTOR LIGANDS WITH ENHANCED DURATION OF ACTION PRLHR, OPRD1, SLC6A3 ALDH1A1 1298/4885HPGD 1391/4885CA2 4649/4885

“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.