Catechol

Catechol

SCHEMBL7725837

OP(O)O.Oc1ccccc1O

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.77
CA2 P00918 6/20 0.77
HPGD P15428 4/20 0.77
TDP1 Q9NUW8 4/20 0.77
CA4 P22748 4/20 0.77
ALOX15 P16050 3/20 0.77
LMNA P02545 3/20 0.77
HSD17B10 Q99714 3/20 0.77
KDM4E B2RXH2 3/20 0.77
SMN1; SMN2 Q16637 3/20 0.77
CA12 O43570 3/20 0.77
CA14 Q9ULX7 3/20 0.77
EGFR P00533 2/20 0.77
FYN P06241 2/20 0.77
MMP9 P14780 2/20 0.77
RECQL P46063 2/20 0.77
NPC1 O15118 2/20 0.77
MAPT P10636 2/20 0.77
CA3 P07451 2/20 0.77
GMNN O75496 1/20 0.77

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 SCHEMBL9239332 1.00 ALDH1A1 (0.77) ALDH1A1CA2HPGDTDP1CA4
Catechol SCHEMBL18351 0.88
Catechol SCHEMBL29352716 0.88
Catechol SCHEMBL30944695 0.88 ALDH1A1 (1.00) ALDH1A1CA2HPGDTDP1CA4
Catechol SCHEMBL367675 0.88 ALDH1A1 (1.00) ALDH1A1CA2HPGDTDP1CA4
Catechol SCHEMBL11672589 0.88 ALDH1A1 (1.00) ALDH1A1CA2HPGDTDP1CA4
Catechol SCHEMBL30088487 0.88
Catechol SCHEMBL10938013 0.86 ALDH1A1 (0.67) ALDH1A1CA2HPGDTDP1CA4
Catechol SCHEMBL10937188 0.86 ALDH1A1 (0.67) ALDH1A1CA2HPGDTDP1CA4
Catechol SCHEMBL7060022 0.86 ALDH1A1 (0.67) ALDH1A1CA2HPGDTDP1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6395894-B2 BACTERICIDES MERCK & CO., INC. 2002-05-28 US claimed
US-20010025103-A1 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES, AND COMPOUNDS PRODUCED MERCK & CO., INC. 2001-09-27 US claimed
EP-1071685-A4 TITANIUM CATALYZED PREPARATION OF CARBAPENEM INTERMEDIATES MERCK & CO INC (US) 2001-07-18 EP claimed
EP-1071685-A1 TITANIUM CATALYZED PREPARATION OF CARBAPENEM INTERMEDIATES Merck & Co., Inc. (US) 2001-01-31 EP claimed
WO-1999052908-A1 TITANIUM CATALYZED PREPARATION OF CARBAPENEM INTERMEDIATES MERCK & CO., INC. (US) 1999-10-21 WO claimed
EP-0211236-A1 7-Oxo-4-thia-1-azabicyclo[3,2,0]hept-2-ene derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1987-02-25 EP claimed
CN-104119376-A Synthesis method of chlorinated pyrocatechol phosphite LIU QIN 2014-10-29 CN disclosed
CN-104119376-A Synthesis method of chlorinated pyrocatechol phosphite LIU QIN 2014-10-29 CN disclosed
US-6395894-B2 BACTERICIDES MERCK & CO., INC. 2002-05-28 US disclosed
US-20010025103-A1 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES, AND COMPOUNDS PRODUCED MERCK & CO., INC. 2001-09-27 US disclosed
EP-1071685-A4 TITANIUM CATALYZED PREPARATION OF CARBAPENEM INTERMEDIATES MERCK & CO INC (US) 2001-07-18 EP disclosed
EP-1071685-A1 TITANIUM CATALYZED PREPARATION OF CARBAPENEM INTERMEDIATES Merck & Co., Inc. (US) 2001-01-31 EP disclosed
WO-1999052908-A1 TITANIUM CATALYZED PREPARATION OF CARBAPENEM INTERMEDIATES MERCK & CO., INC. (US) 1999-10-21 WO disclosed
EP-0212404-A1 7-oxo-4-thia-1-azabicyclo [3.2.0] hept-2-ene derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-04 EP disclosed
EP-0211236-A1 7-Oxo-4-thia-1-azabicyclo[3,2,0]hept-2-ene derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1987-02-25 EP disclosed
EP-0058317-B1 PROCESS FOR THE PREPARATION OF 2-PENEM COMPOUNDS SCHERING CORPORATION (US) 1986-08-27 EP disclosed
US-4495320-A 3,6-Di-t-butyl-2-naphthyl catechol phosphite and compositions thereof THE B. F. GOODRICH COMPANY (US) 1985-01-22 US disclosed
EP-0102239-A1 Azetidinone derivatives, a process for their preparation and their use as intermediates in the preparation of carbapenem antibiotics SANKYO COMPANY LIMITED (JP) 1984-03-07 EP disclosed
US-4416829-A OXIDATION AND CORROSION RESISTANCE TO LUBRICANT OILS STANDARD OIL COMPANY (INDIANA) (US) 1983-11-22 US disclosed
EP-0058317-A1 Process for the preparation of 2-penem compounds SCHERING CORPORATION (US) 1982-08-25 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-20010025103-A1 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES, AND COMPOUNDS PRODUCED HAAO, HACL2, HAO2 ALDH1A1 883/4885CA2 2735/4885HPGD 212/4885

“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.