SCHEMBL13799956

SCHEMBL13799956

[2H]CN(C)Cc1ccc(C(=O)NCCC(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.51
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ LSS P48449 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ TMEM97 Q5BJF2 9/20 0.46
▸ SIGMAR1 Q99720 9/20 0.46
▸ GCGR P47871 3/20 0.46
▸ HRH3 Q9Y5N1 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GIPR P48546 1/20 0.44
▸ ACKR3 P25106 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL13800496 0.83 MAPT (0.47) MCHR1LSSTMEM97SIGMAR1SMN1; SMN2
SCHEMBL2663436 0.82 SIGMAR1 (0.55) CA1CA2MAPK1TMEM97SIGMAR1
SCHEMBL13800570 0.81 CA1 (0.50) MCHR1CA1CA2MAPK1TMEM97
SCHEMBL13800502 0.79 CA1 (0.45) MCHR1CA1CA2MAPK1TMEM97
SCHEMBL9717434 0.78 MAPK1 (0.71) CA1CA2MAPK1HRH3SMN1; SMN2
SCHEMBL2663435 0.78 CA1 (0.52) CA1CA2MAPK1TMEM97SIGMAR1
SCHEMBL3199550 0.77 GCGR (0.58) CA1CA2MAPK1GCGRHRH3
SCHEMBL13799721 0.77 ALDH1A1 (0.52) HRH3SMN1; SMN2L3MBTL1
SCHEMBL14045108 0.76 MCHR1 (0.62) MCHR1LSSTMEM97SIGMAR1SMN1; SMN2
SCHEMBL2650667 0.75 LSS (0.58) MCHR1CA1CA2LSSTMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 — — 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-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR MCHR1 178/4885CA1 4464/4885CA2 3233/4885

“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.

Send feedback