SCHEMBL992852

SCHEMBL992852

CN[C@@H](CC(N)=O)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 4/20 0.44
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 1/20 0.33
CA2 P00918 2/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
CA1 P00915 1/20 0.31
PDCD1LG2 Q9BQ51 1/20 0.30
CD274 Q9NZQ7 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL24915343 1.00 ECE1 (0.44) ECE1ITGB2ICAM1ITGALCA2
SCHEMBL992850 1.00 ECE1 (0.44) ECE1ITGB2ICAM1ITGALCA2
SCHEMBL10442189 0.88 ECE1 (0.40) ECE1ITGB2ICAM1ITGALCA2
SCHEMBL12661237 0.88 ECE1 (0.40) ECE1ITGB2ICAM1ITGALCA2
SCHEMBL13233706 0.88 ECE1 (0.40) ECE1ITGB2ICAM1ITGALCA2
SCHEMBL160994 0.83 ECE1 (0.49) ECE1ITGB2ICAM1ITGALCA2
SCHEMBL8729434 0.83 SLC22A6 (0.36) CA2
SCHEMBL15866495 0.83 ECE1 (0.37) ECE1ITGB2ICAM1ITGALCA2
SCHEMBL14490960 0.83 SLC22A6 (0.36) CA2
SCHEMBL515169 0.83 ECE1 (0.49) ECE1ITGB2ICAM1ITGALCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2106279-A2 STATIONARY PHASE GRADIENT CHROMATOGRAPHY Cryobiophysica, Inc. (US) 2009-10-07 EP claimed
US-20080179243-A1 Stationary Phase Gradient Chromatography HIRSH ALLEN 2008-07-31 US claimed
WO-2008086357-A2 STATIONARY PHASE GRADIENT CHROMATOGRAPHY CRYOBIOPHYSICA, INC. (US) 2008-07-17 WO claimed
US-20240219307-A1 APPARATUS FOR CONDUCTING CONTINUOUS INTERLEAVED ASSAYING IN A MULTI-WELL PLATE MESO SCALE TECHNOLOGIES, LLC. (US) 2024-07-04 US disclosed
US-20240159766-A1 ASSAY APPARATUSES, METHODS AND REAGENTS MESO SCALE TECHNOLOGIES, LLC. (US) 2024-05-16 US disclosed
US-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF PARABILIS MEDICINES, INC. 2024-04-11 US disclosed
US-11940385-B2 Apparatus for conducting continuous interleaved assaying in a multi-well plate MESO SCALE TECHNOLOGIES, LLC. (US) 2024-03-26 US disclosed
US-11892455-B2 Assay apparatuses, methods and reagents MESO SCALE TECHNOLOGIES, LLC. (US) 2024-02-06 US disclosed
EP-1963854-B1 ASSAY APPARATUSES, METHODS AND REAGENTS MESO SCALE TECHNOLOGIES LLC (US) 2021-02-03 EP disclosed
US-20210025896-A1 Assay Apparatuses, Methods and Reagents MESO SCALE TECHNOLOGIES, LLC. 2021-01-28 US disclosed
US-10794914-B2 Assay apparatuses, methods and reagents MESO SCALE TECHNOLOGIES, LLC (US) 2020-10-06 US disclosed
EP-2269026-A2 ASSAY APPARATUSES, METHODS AND REAGENTS Meso Scale Technologies, LLC (US) 2011-01-05 EP disclosed
US-20090263904-A1 ASSAY APPARATUSES, METHODS AND REAGENTS MESO SCALE TECHNOLOGIES, LLC 2009-10-22 US disclosed
WO-2009126303-A2 ASSAY APPARATUSES, METHODS AND REAGENTS MESO SCALE TECHNOLOGIES, LLC (US) 2009-10-15 WO disclosed
EP-2106279-A2 STATIONARY PHASE GRADIENT CHROMATOGRAPHY Cryobiophysica, Inc. (US) 2009-10-07 EP disclosed
EP-1963854-A2 ASSAY APPARATUSES, METHODS AND REAGENTS Meso Scale Technologies, LLC (US) 2008-09-03 EP disclosed
US-20080179243-A1 Stationary Phase Gradient Chromatography HIRSH ALLEN 2008-07-31 US disclosed
WO-2008086357-A2 STATIONARY PHASE GRADIENT CHROMATOGRAPHY CRYOBIOPHYSICA, INC. (US) 2008-07-17 WO disclosed
WO-2008057111-A2 ASSAY APPARATUSES, METHODS AND REAGENTS MESO SCALE TECHNOLOGIES, LLC (US) 2008-05-15 WO disclosed
US-20070231217-A1 Assay apparatuses, methods and reagents UNITED STATES GOVERNMENT; DEFENSE THREAT REDUCTION AGENCY 2007-10-04 US 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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF CTNNB1, APC, CTNNA1 ECE1 1922/4885ITGB2 777/4885ICAM1 296/4885

“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.