SCHEMBL25186381

SCHEMBL25186381

O=C(O)[C@@H]1C[C@@H](OCc2cccnc2)CN1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 3/20 0.52
▸ CHRM1 P11229 3/20 0.52
▸ CHRM3 P20309 3/20 0.52
▸ CHRNB2 P17787 2/20 0.52
▸ CHRNA4 P43681 2/20 0.52
▸ HSD11B1 P28845 1/20 0.46
▸ CYP17A1 P05093 2/20 0.45
▸ CYP19A1 P11511 2/20 0.45
▸ NAPRT Q6XQN6 1/20 0.42
▸ BACE1 P56817 1/20 0.40
▸ BACE2 Q9Y5Z0 1/20 0.40
▸ KDM4E B2RXH2 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
SCHEMBL30510410 1.00 CHRM2 (0.52) CHRM2CHRM1CHRM3CHRNB2CHRNA4
SCHEMBL25417080 1.00 CHRM2 (0.52) CHRM2CHRM1CHRM3CHRNB2CHRNA4
SCHEMBL6374726 0.85 CTSC (0.44) —
SCHEMBL16920345 0.85 CTSC (0.44) —
SCHEMBL1006317 0.85 CTSC (0.44) —
SCHEMBL5802417 0.85 CTSC (0.44) —
SCHEMBL1006316 0.85 CTSC (0.44) —
SCHEMBL1006306 0.85 CTSC (0.44) —
SCHEMBL1768681 0.85 CTSC (0.44) —
Hydrochloric Acid SCHEMBL5862743 0.84 GRIK1 (0.45) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-07-29 — — US disclosed
US-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-12-05 — — US disclosed
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-09 — — US disclosed
EP-4316503-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-02-07 — — EP disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 — — US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 — — US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 — — 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 (4 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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS CHRM2 4873/4885CHRM1 4827/4885CHRM3 4855/4885
US-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS CHRM2 4873/4885CHRM1 4827/4885CHRM3 4855/4885
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND VIP, IAPP, KRAS CHRM2 4435/4885CHRM1 4470/4885CHRM3 3434/4885
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action KRAS, NRAS, HRAS CHRM2 4873/4885CHRM1 4827/4885CHRM3 4855/4885

“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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