SCHEMBL31097656

SCHEMBL31097656

NCCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.49
▸ F2 P00734 2/20 0.47
▸ ACE P12821 6/20 0.46
▸ DPP4 P27487 3/20 0.45
▸ DPP7 Q9UHL4 3/20 0.45
▸ DPP8 Q6V1X1 2/20 0.45
▸ DPP9 Q86TI2 2/20 0.45
▸ FAP Q12884 1/20 0.45
▸ NTSR2 O95665 3/20 0.43
▸ NTSR1 P30989 3/20 0.43
▸ SORT1 Q99523 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ REN P00797 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ LTA4H P09960 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PEPD P12955 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ HTR2A P28223 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
SCHEMBL30116344 0.93 ACE (0.47) OPRM1F2ACENTSR2NTSR1
SCHEMBL29380256 0.90 OPRM1 (0.46) OPRM1F2ACENTSR2NTSR1
SCHEMBL31114414 0.89 ACE (0.53) OPRM1F2ACEDPP4DPP7
SCHEMBL30292653 0.89 ACE (0.47) OPRM1F2ACEKDM4EREN
SCHEMBL30116354 0.89 ACE (0.47) OPRM1F2ACEKDM4EREN
SCHEMBL29379729 0.89 ACE (0.47) OPRM1F2ACEDPP4DPP7
SCHEMBL29721144 0.87 ACE (0.52) F2ACEDPP4DPP7DPP8
SCHEMBL31268702 0.87 ACE (0.55) OPRM1F2ACEDPP4DPP7
SCHEMBL31268656 0.87 ACE (0.55) OPRM1F2ACEDPP4DPP7
SCHEMBL30011765 0.87 CAPN1 (0.49) F2ACENTSR2NTSR1SORT1

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-20240293512-A1 THERAPEUTIC USE OF COMBINATION INCLUDING TRIPLE AGONIST HAVING ACTIVITIES TO ALL OF GLUCAGON, GLP-1, AND GIP RECEPTORS HANMI PHARM. CO., LTD. (KR) 2024-09-05 — — 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-20240293512-A1 THERAPEUTIC USE OF COMBINATION INCLUDING TRIPLE AGONIST HAVING ACTIVITIES TO ALL OF GLUCAGON, GLP-1, AND GIP RECEPTORS GLP1R, GIPR, GCGR OPRM1 1955/4885F2 4445/4885ACE 1139/4885

“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.

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