SCHEMBL9906230

SCHEMBL9906230

NCCNC(=O)c1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
CA9 Q16790 9/20 0.62
MEN1 O00255 1/20 0.56
ALPL P05186 1/20 0.56
POLB P06746 1/20 0.56
ALPI P09923 1/20 0.56
ALPG P10696 1/20 0.56
KMT2A Q03164 1/20 0.56
ALB P02768 1/20 0.56
FOLH1 Q04609 2/20 0.56
CA1 P00915 7/20 0.55
CA2 P00918 7/20 0.55
CA12 O43570 5/20 0.54
CA14 Q9ULX7 2/20 0.54
CA7 P43166 1/20 0.54
SLC5A2 P31639 1/20 0.53
ESR1 P03372 1/20 0.52

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
SCHEMBL15130552 0.93 USP2 (0.62) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL16153102 0.92 USP2 (0.64) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL12086245 0.91 USP2 (0.60) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL23258882 0.91 USP2 (0.63) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL15143443 0.91 USP2 (0.63) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL15143488 0.90 USP2 (0.62) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL12464765 0.90 USP2 (0.62) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL13656547 0.89 USP2 (0.72) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL12464671 0.89 USP2 (0.61) USP2L3MBTL1CA9MEN1ALPL
SCHEMBL15717108 0.89 USP2 (0.61) USP2L3MBTL1CA9MEN1ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9850469-B2 Methods of stapling and unstapling peptides and proteins THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-12-26 US disclosed
EP-1673399-B1 DETECTING AND PROFILING MOLECULAR COMPLEXES MONOGRAM BIOSCIENCES INC (US) 2017-04-05 EP disclosed
US-20150376579-A1 Methods Of Stapling And Unstapling Peptides And Proteins NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-12-31 US disclosed
US-8198031-B2 Using epidermal growth factor receptor complexes to diagnose and prognose health in cancer patients; drug screening MONOGRAM BIOSCIENCES, INC. (US) 2012-06-12 US disclosed
EP-1540347-B1 DETECTING RECEPTOR OLIGOMERIZATION ACLARA BIOSCIENCES INC (US) 2009-09-09 EP disclosed
US-20090173631-A1 Single Cell Analysis of Membrane Molecules ACLARA BIOSCIENCES, INC. 2009-07-09 US disclosed
US-20090011432-A1 Detecting and Profiling Molecular Complexes MONOGRAM BIOSCIENCES, INC. (US) 2009-01-08 US disclosed
US-20080233602-A1 Detecting and profiling molecular complexes MONOGRAM BIOSCIENCES, INC. 2008-09-25 US disclosed
US-7402397-B2 Detecting and profiling molecular complexes MONOGRAM BIOSCIENCES, INC. (US) 2008-07-22 US disclosed
US-7255999-B2 Detection of preferential polypetide in sample; otain sample containing preferential polyeptide, electrophorese, incubate with probe, detect signal from probe and recover polypeptide MONOGRAM BIOSCIENCES, INC. (US) 2007-08-14 US disclosed
US-7160735-B2 Tagged microparticle compositions and methods MONOGRAM BIOSCIENCES, INC. (US) 2007-01-09 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-20150376579-A1 Methods Of Stapling And Unstapling Peptides And Proteins SCLY, TST, SPPL2B USP2 489/4885L3MBTL1 896/4885CA9 2578/4885

“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.