SCHEMBL9915399

SCHEMBL9915399

Cc1cc(=O)c(O)cn1O

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.53
COMT P21964 1/20 0.44

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
SCHEMBL16269997 0.79 TYR (0.37) TYRCOMT
SCHEMBL2117724 0.77 TYR (0.58) TYRCOMT
SCHEMBL12968429 0.74 TYR (0.38) TYRCOMT
SCHEMBL9353838 0.74 COMT (0.54) TYRCOMT
SCHEMBL1686873 0.73 TYR (0.36) TYRCOMT
SCHEMBL24635878 0.72 TYR (0.37) TYRCOMT
SCHEMBL11925263 0.72 TYR (0.44) TYRCOMT
SCHEMBL19331472 0.72 TYR (0.49) TYRCOMT
SCHEMBL14288985 0.72 HDAC4 (0.40) TYRCOMT
SCHEMBL17191934 0.72 COMT (0.49) TYRCOMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746111-B2 Siderophore conjugated pyrazolidinones, and analogues thereof YALE UNIVERSITY (US) 2023-09-05 US disclosed
EP-4074709-A1 MONOCYCLIC BETA-LACTAM COMPOUND AND USE THEREOF Evopoint Biosciences Co., Ltd. (CN) 2022-10-19 EP disclosed
EP-2834239-B1 HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS ENTASIS THERAPEUTICS LTD (GB) 2017-12-27 EP disclosed
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 US disclosed
US-9623014-B2 β-lactamase inhibitor compounds ENTASIS THERAPEUTICS LIMITED (GB) 2017-04-18 US disclosed
US-20160175290-A1 BETA-LACTAMASE INHIBITOR COMPOUNDS ASTRAZENECA PHARMACEUTICALS LP 2016-06-23 US disclosed
US-9309245-B2 Beta-lactamase inhibitor compounds ENTASIS THERAPEUTICS LIMITED (GB) 2016-04-12 US disclosed
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LTD (GB) 2015-10-22 US disclosed
US-20150148326-A1 Monobactams PFIZER (US) 2015-05-28 US disclosed
US-20150148326-A1 Monobactams PFIZER (US) 2015-05-28 US disclosed
US-20150073011-A1 Beta-Lactamase Inhibitor Compounds ASTRAZENECA AB (SE) 2015-03-12 US disclosed
US-8901293-B2 Useful combinations of monobactam antibiotics with beta-lactamase inhibitors BASILEA PHARMACEUTICA AG (CH) 2014-12-02 US disclosed
WO-2014068388-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-05-08 WO disclosed
WO-2013150296-A1 HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS ASTRAZENECA AB (SE) 2013-10-10 WO disclosed
US-20130252935-A1 Monobactams PFIZER INC. (US) 2013-09-26 US disclosed
US-20130252935-A1 Monobactams PFIZER INC. (US) 2013-09-26 US disclosed
US-20120302542-A1 MONOBACTAMS PFIZER INC 2012-11-29 US disclosed
US-20120302542-A1 MONOBACTAMS PFIZER INC 2012-11-29 US disclosed
WO-2012073138-A1 MONOBACTAMS PFIZER INC. (US) 2012-06-07 WO disclosed
EP-1965798-B1 USEFUL MONOBACTAM ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2011-10-19 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 (8 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-11746111-B2 Siderophore conjugated pyrazolidinones, and analogues thereof SLC40A1, HAMP, SLC39A11 TYR 2524/4885COMT 3168/4885
US-20130252935-A1 Monobactams MGAM, MGAM2, BPGM TYR 4830/4885COMT 1386/4885
US-20150148326-A1 Monobactams MGAM, MGAM2, BPGM TYR 4830/4885COMT 1386/4885
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS CEP170, CES2, CMBL TYR 734/4885COMT 62/4885
US-20160175290-A1 BETA-LACTAMASE INHIBITOR COMPOUNDS LCT, MGAM, SI TYR 4058/4885COMT 646/4885
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 TYR 318/4885COMT 279/4885
US-20150073011-A1 Beta-Lactamase Inhibitor Compounds LCT, MGAM, SI TYR 4058/4885COMT 646/4885
US-20120302542-A1 MONOBACTAMS MGAM, MGAM2, BPGM TYR 4830/4885COMT 1386/4885

“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.