SCHEMBL16288443

SCHEMBL16288443

C=CCCC(=O)NC(Cc1cccc(I)c1)C(=O)OCC#N

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSB P07858 7/20 0.45
ACE P12821 1/20 0.36
OPRK1 P41145 1/20 0.36
CTSS P25774 4/20 0.35
CTSL P07711 3/20 0.35
ALB P02768 1/20 0.35
IL2 P60568 1/20 0.35
CTSK P43235 3/20 0.34
FOLH1 Q04609 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL15083401 1.00 CTSB (0.45) CTSBACEOPRK1CTSSCTSL
SCHEMBL16288777 0.88 HDAC1 (0.38) CTSBACECTSSCTSL
SCHEMBL15083394 0.88 HDAC1 (0.38) CTSBACECTSSCTSL
SCHEMBL7074221 0.88 ACE (0.47) CTSBACECTSSCTSLCTSK
SCHEMBL7074223 0.88 ACE (0.47) CTSBACECTSSCTSLCTSK
SCHEMBL20630582 0.88 CTSL (0.46) CTSBCTSSCTSLCTSK
SCHEMBL20630581 0.88 CTSL (0.46) CTSBCTSSCTSLCTSK
SCHEMBL16574816 0.86 OPRK1 (0.48) OPRK1POLB
SCHEMBL22686106 0.84 CTSS (0.48) CTSBACECTSSCTSLCTSK
SCHEMBL20467688 0.82 NLRP3 (0.41) CTSBACECTSSCTSLCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 US disclosed
US-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-23 US disclosed
US-11891457-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-02-06 US disclosed
EP-3974563-A1 CYCLIC PEPTIDES Chugai Seiyaku Kabushiki Kaisha (JP) 2022-03-30 EP disclosed
EP-2813512-B1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI PHARMACEUTICAL CO LTD (JP) 2021-03-31 EP disclosed
US-20210061860-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2021-03-04 US disclosed
US-20160311858-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-10-27 US disclosed
US-9409952-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-08-09 US disclosed
US-20150080549-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-03-19 US disclosed
EP-2813512-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD Chugai Seiyaku Kabushiki Kaisha (JP) 2014-12-17 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 (6 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-11891457-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R CTSB 159/4885ACE 621/4885OPRK1 4394/4885
US-20210061860-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R CTSB 159/4885ACE 621/4885OPRK1 4394/4885
US-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R CTSB 159/4885ACE 621/4885OPRK1 4394/4885
US-20160311858-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R CTSB 159/4885ACE 621/4885OPRK1 4394/4885
US-20150080549-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R CTSB 159/4885ACE 621/4885OPRK1 4394/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R CTSB 159/4885ACE 621/4885OPRK1 4394/4885

“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.