SCHEMBL2652463

SCHEMBL2652463

CCCCN(CCCC)c1ccc(-c2nc3cc(C(=O)NCCC(=O)O)ccc3n2CCOc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 11/20 0.51
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
SIRT2 Q8IXJ6 2/20 0.46
PIN1 Q13526 3/20 0.45
NPC1 O15118 1/20 0.43
EPHX2 P34913 1/20 0.43
RIPK2 O43353 1/20 0.43
SIRT1 Q96EB6 1/20 0.42

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
SCHEMBL2652327 0.82 PTGER4 (0.49) PTGER4PIN1NPC1
SCHEMBL2661770 0.80 PPARG (0.52) HDAC1HDAC6SIRT2
SCHEMBL2651903 0.80 HDAC1 (0.41) HDAC1HDAC6SIRT2
SCHEMBL2653452 0.79 RIPK2 (0.45) PTGER4HDAC6SIRT2PIN1NPC1
SCHEMBL9251208 0.76 ITGB3 (0.53) PTGER4SIRT2EPHX2
SCHEMBL2651445 0.76 MRGPRX1 (0.49) PTGER4PIN1NPC1
SCHEMBL2661876 0.75 PTGER4 (0.51) PTGER4PIN1RIPK2
SCHEMBL9255722 0.75 SIRT2 (0.51) PTGER4SIRT2EPHX2
SCHEMBL9246297 0.75 PTGER4 (0.58) PTGER4RIPK2
Bromide SCHEMBL9248603 0.74 SIRT2 (0.51) PTGER4SIRT2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212119-A1 Novel glucagon receptor antagonists/inverse agonists NOVO NORDISK A/S (DK) 2003-11-13 US disclosed
WO-2003053938-A1 BENZIMIDAZOLS AND INDOLS AS GLUCAGON RECEPTOR ANTAGONISTS/INVERSE AGONISTEN NOVO NORDISK A/S (DK) 2003-07-03 WO disclosed
WO-2003053938-A1 BENZIMIDAZOLS AND INDOLS AS GLUCAGON RECEPTOR ANTAGONISTS/INVERSE AGONISTEN NOVO NORDISK A/S (DK) 2003-07-03 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-20030212119-A1 Novel glucagon receptor antagonists/inverse agonists GLP1R, GCGR, GIPR PTGER4 412/4885HDAC1 3760/4885HDAC6 3834/4885

“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.