SCHEMBL1403590

SCHEMBL1403590

CCOC(=O)CCNC(=O)c1ccc(B(O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
PRSS1 P07477 1/20 0.48
CTSG P08311 1/20 0.48
CTRB1 P17538 1/20 0.48
CMA1 P23946 1/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C19 P33261 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
TRPV1 Q8NER1 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
SCHEMBL2557121 0.87 PRSS1 (0.51) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL17165865 0.85 NPC1 (0.63) MAPTSMN1; SMN2NPC1RAB9AMEN1
SCHEMBL14679110 0.85 LMNA (0.58) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL1081623 0.84 SMN1; SMN2 (0.47) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL2273609 0.84 MAPT (0.56) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL23782641 0.82 HPGD (0.61) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL14172931 0.82 MAPT (0.55) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL718603 0.82 LMNA (0.56) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL8879612 0.82 MAPT (0.55) MAPTSMN1; SMN2PRSS1CTSGCTRB1
SCHEMBL27439930 0.82 PRSS1 (0.71) MAPTSMN1; SMN2PRSS1CTSGCTRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-2291358-B1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE MERCK SHARP & DOHME (US) 2018-03-28 EP disclosed
US-8623818-B2 Glucagon receptor antagonists, compositions, and methods for their use MERCK SHARP & DOHME CORP. (US) 2014-01-07 US disclosed
US-20110065634-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
US-20110065634-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
EP-2291358-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE Schering Corporation (US) 2011-03-09 EP disclosed
WO-2009140342-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE SCHERING CORPORATION (US) 2009-11-19 WO disclosed
WO-2009140342-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE SCHERING CORPORATION (US) 2009-11-19 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 (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-20110065634-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE GLP1R, GCGR, GIPR MAPT 4808/4885SMN1; SMN2 4692/4885PRSS1 1571/4885

“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.