SCHEMBL4462153

SCHEMBL4462153

O=C(O)N1CC=C[C@@H]1CO

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.40

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
SCHEMBL24823115 0.76 ACE (0.61) ACE
SCHEMBL31312437 0.74 ACE (0.34) ACE
SCHEMBL4461003 0.70 ACE (0.59) ACE
SCHEMBL4454388 0.70 ACE (0.59) ACE
SCHEMBL2229670 0.70 ACE (0.59) ACE
SCHEMBL31510820 0.70
SCHEMBL3390437 0.69 POLB (0.34) ACE
SCHEMBL8321174 0.69
SCHEMBL24820366 0.69
SCHEMBL1075993 0.67 ACE (0.43) ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118027068-A Compound containing bridged ring and application thereof 上海艾力斯医药科技股份有限公司 2024-05-14 CN disclosed
CN-117430619-A Pyrazolopyridine compound and preparation method and application thereof 上海艾力斯医药科技股份有限公司 2024-01-23 CN disclosed
CN-116731044-A Pyrimidine-containing polycyclic biological inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-09-12 CN disclosed
US-20090042854-A1 Hexahydro-3H-Pyrrolizin-3-Ones Useful as Tachykinin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-02-12 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-20090042854-A1 Hexahydro-3H-Pyrrolizin-3-Ones Useful as Tachykinin Receptor Antagonists TACR1, PROKR1, TACR2 ACE 196/4885

“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.