SCHEMBL452919

SCHEMBL452919

CNC(=O)OCc1ccc(O)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
TOP2A P11388 2/20 0.51
TOP2B Q02880 2/20 0.51
MIF P14174 2/20 0.49
ALDH1A1 P00352 1/20 0.46
LMNA P02545 2/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
TMEM97 Q5BJF2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
IDO1 P14902 1/20 0.43

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
SCHEMBL20497346 0.94 MEN1 (0.50) MEN1KMT2ATOP2ATOP2BMIF
SCHEMBL1936309 0.86 TOP2A (0.50) MEN1KMT2ATOP2ATOP2BALDH1A1
SCHEMBL18232048 0.86 NAAA (0.54) MEN1KMT2ATOP2ATOP2BALDH1A1
SCHEMBL12898184 0.86 NAAA (0.54) TOP2ATOP2BALDH1A1NPC1RAB9A
SCHEMBL23275293 0.85 TOP2A (0.49) TOP2ATOP2BALDH1A1NPC1RAB9A
SCHEMBL13632263 0.85 GAA (0.55) MEN1KMT2ATOP2ATOP2BALDH1A1
SCHEMBL20497336 0.85 KMT2A (0.51) MEN1KMT2ATOP2ATOP2BALDH1A1
SCHEMBL16772111 0.85 TOP2A (0.49) TOP2ATOP2BALDH1A1LMNANPC1
SCHEMBL20160133 0.85 TOP2A (0.49) MEN1KMT2ATOP2ATOP2BALDH1A1
SCHEMBL12291924 0.85 TOP2A (0.49) MEN1KMT2ATOP2ATOP2BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238711-B1 Compounds and methods to inhibit or augment an inflammatory response CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. (GB) 2007-07-03 US claimed
EP-3655394-B1 NOVEL ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS UNIV BERLIN TECH (DE) 2023-11-22 EP disclosed
EP-2956437-B1 ALBICIDIN DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS UNIV BERLIN TECH (DE) 2023-05-10 EP disclosed
US-9416390-B2 Electric measurement of monolayers following pro-cleave detection of presence and activity of enzymes and other target analytes OHMX CORPORATION (US) 2016-08-16 US disclosed
US-20140027310-A1 ELECTRIC MEASUREMENT OF MONOLAYERS FOLLOWING PRO-CLEAVE DETECTION OF PRESENCE AND ACTIVITY OF ENZYMES AND OTHER TARGET ANALYTES OHMX CORPORATION 2014-01-30 US disclosed
US-8481558-B2 Compounds to inhibit or augment an inflammatory response CAMBRIDGE ENTERPRISE LIMITED (GB) 2013-07-09 US disclosed
US-20120065401-A1 METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE CAMBRIDGE ENTERPRISE LIMITED (GB) 2012-03-15 US disclosed
EP-2386565-A2 Compounds and methods to inhibit or augment an inflammatory response Cambridge Enterprise Ltd. (GB) 2011-11-16 EP disclosed
US-7989466-B2 Administering chemokine peptides, variants, and derivatives thereof, as well as chemokine peptide analogs to modulate the migration or recruitment of leukocytes to a preselected physiological site CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-08-02 US disclosed
US-20080045557-A1 Administering chemokine peptides, variants, and derivatives thereof, as well as chemokine peptide analogs to modulate the migration or recruitment of leukocytes to a preselected physiological site CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. 2008-02-21 US disclosed
US-7238711-B1 Compounds and methods to inhibit or augment an inflammatory response CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. (GB) 2007-07-03 US disclosed
EP-1141011-A2 COMPOUNDS AND METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE NEORX CORPORATION (US) 2001-10-10 EP disclosed
WO-2000042071-A2 COMPOUNDS AND METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. (GB) 2000-07-20 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-20080045557-A1 Administering chemokine peptides, variants, and derivatives thereof, as well as chemokine peptide analogs to modulate the migration or recruitment of leukocytes to a preselected physiological site CCL2, CCL11, CCL5 MEN1 2434/4885KMT2A 4857/4885TOP2A 4744/4885
US-20120065401-A1 METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE CCL2, CCL5, CCL11 MEN1 4511/4885KMT2A 4863/4885TOP2A 4115/4885

“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.