SCHEMBL452918

SCHEMBL452918

[CH2]NC(=O)OCc1ccc(O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
MIF P14174 2/20 0.46
LMNA P02545 2/20 0.46
IDO1 P14902 2/20 0.43
ALDH1A1 P00352 1/20 0.42
ESR1 P03372 2/20 0.42
ESR2 Q92731 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CA2 P00918 2/20 0.42
CAMK2A Q9UQM7 1/20 0.42
PRSS1 P07477 1/20 0.41
TPSAB1 Q15661 1/20 0.41
TPSD1 Q9BZJ3 1/20 0.41
TPSG1 Q9NRR2 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41

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
SCHEMBL25271685 0.85 PLAU (0.45) MEN1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL645203 0.84 LMNA (0.59) KMT2ALMNAALDH1A1SMN1; SMN2CA2
SCHEMBL11722992 0.80 MEN1 (0.55) MEN1KMT2AMIFLMNAIDO1
SCHEMBL452919 0.80 MEN1 (0.55) MEN1KMT2AMIFLMNAIDO1
SCHEMBL6395921 0.79 IDO1 (0.53) IDO1ALDH1A1
SCHEMBL8314405 0.77 MEN1 (0.61) MEN1KMT2ALMNAIDO1ALDH1A1
SCHEMBL10438809 0.77 MEN1 (0.61) MEN1KMT2AMIFLMNAIDO1
SCHEMBL13590480 0.76 TOP2A (0.54) MEN1KMT2AMIFESR1ESR2
SCHEMBL20497346 0.76 MEN1 (0.50) MEN1KMT2AMIF
SCHEMBL27571682 0.76 TSHR (0.51) MEN1KMT2AMIFLMNAALDH1A1

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 9 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
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 4857/4885MIF 27/4885
US-20120065401-A1 METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE CCL2, CCL5, CCL11 MEN1 4511/4885KMT2A 4863/4885MIF 7/4885

“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.