SCHEMBL30051146

SCHEMBL30051146

COC(=O)[C@@H]1CCCN1C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.62
CYP3A4 P08684 1/20 0.62
TSHR P16473 1/20 0.62
CAPN1 P07384 3/20 0.58
CTSL P07711 1/20 0.57
CTSB P07858 1/20 0.57
CTSK P43235 1/20 0.57
PREP P48147 2/20 0.56
CCR1 P32246 2/20 0.56
FKBP1A P62942 1/20 0.54
ELANE P08246 4/20 0.54
CMA1 P23946 4/20 0.53
ACE P12821 1/20 0.52

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
SCHEMBL22209363 1.00 ALDH1A1 (0.62) ALDH1A1CYP3A4TSHRCAPN1CTSL
SCHEMBL1506200 1.00 ALDH1A1 (0.62) ALDH1A1CYP3A4TSHRCAPN1CTSL
SCHEMBL22209519 0.97 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRCAPN1CTSL
SCHEMBL18620866 0.97 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRCAPN1CTSL
SCHEMBL1992452 0.92 FKBP1A (0.60) ALDH1A1CYP3A4TSHRCAPN1CTSL
SCHEMBL1506251 0.92 ACE (0.61) CAPN1CTSLCTSBCTSKPREP
SCHEMBL10063674 0.92 ACE (0.61) CAPN1CTSLCTSBCTSKPREP
SCHEMBL22209535 0.91 CYP3A4 (0.60) ALDH1A1CYP3A4TSHRCAPN1CTSL
SCHEMBL18619599 0.91 CYP3A4 (0.60) ALDH1A1CYP3A4TSHRCAPN1CTSL
SCHEMBL7285235 0.90 CMA1 (0.60) CAPN1CTSLCTSBCTSKPREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250257094-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-08-14 US disclosed
US-12312379-B2 Methods for producing cyclic compounds comprising N-substituted amino acid residues CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-05-27 US disclosed
US-20220411462-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-12-29 US disclosed
WO-2022234864-A1 METHOD FOR PRODUCING CYCLIC COMPOUND CONTAINING N-SUBSTITUTED AMINO ACID RESIDUE 中外製薬株式会社 2022-11-10 WO disclosed
EP-4086272-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES Chugai Seiyaku Kabushiki Kaisha (JP) 2022-11-09 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 (3 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-20220411462-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES NGLY1, NPPA, VIP ALDH1A1 4672/4885CYP3A4 2479/4885TSHR 3943/4885
US-12312379-B2 Methods for producing cyclic compounds comprising N-substituted amino acid residues NGLY1, NPPA, VIP ALDH1A1 4672/4885CYP3A4 2479/4885TSHR 3943/4885
US-20250257094-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES NGLY1, NPPA, VIP ALDH1A1 4672/4885CYP3A4 2479/4885TSHR 3943/4885

“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.