SCHEMBL23922778

SCHEMBL23922778

CCc1cc2n(n1)[C@@H](COC1CCN(c3ncc(F)cn3)CC1)[C@@H](NS(C)(=O)=O)CC2

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 20/20 0.58

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
SCHEMBL22092262 1.00 HCRTR2 (0.58) HCRTR2
SCHEMBL31179754 1.00 HCRTR2 (0.58) HCRTR2
SCHEMBL24214615 0.91 HCRTR2 (0.47) HCRTR2
SCHEMBL23922973 0.91 HCRTR2 (0.47) HCRTR2
SCHEMBL23922958 0.91 HCRTR2 (0.56) HCRTR2
SCHEMBL30533892 0.91 HCRTR2 (0.56) HCRTR2
SCHEMBL24214540 0.91 HCRTR2 (0.56) HCRTR2
SCHEMBL24214520 0.90 HCRTR2 (0.60) HCRTR2
SCHEMBL23923095 0.90 HCRTR2 (0.60) HCRTR2
SCHEMBL24214268 0.90 HCRTR2 (0.47) HCRTR2

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
US-12091410-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-09-17 US disclosed
EP-3896060-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2023-08-16 EP disclosed
US-20220017514-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-01-20 US disclosed
EP-3896060-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2021-10-20 EP 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 (2 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-12091410-B2 Heterocyclic compound HCRTR2, HCRTR1, NTSR2 HCRTR2 1/4885
US-20220017514-A1 HETEROCYCLIC COMPOUND HCRTR2, HCRTR1, NTSR2 HCRTR2 1/4885

“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.