SCHEMBL27334440

SCHEMBL27334440

CCN[C@@H](Cc1ccccc1)C(=O)NCC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 4/20 0.51
▸ CTSK P43235 2/20 0.51
▸ BCHE P06276 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CTSL P07711 4/20 0.46
▸ CTSB P07858 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ ACE P12821 2/20 0.46
▸ ANPEP P15144 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ MME P08473 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44

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
SCHEMBL24476234 1.00 CTSS (0.51) CTSSCTSKBCHESIGMAR1L3MBTL1
SCHEMBL18435163 0.88 CTSS (0.52) CTSSCTSKBCHESIGMAR1L3MBTL1
SCHEMBL16217879 0.87 GRIA1 (0.44) CTSLACEMME
SCHEMBL25034734 0.86 POLB (0.50) CTSSCTSKBCHEL3MBTL1CTSL
SCHEMBL16656682 0.85 CTSS (0.54) CTSSCTSKCTSLCTSBACE
SCHEMBL22695725 0.85 CTSS (0.54) CTSSCTSKCTSLCTSBACE
SCHEMBL18435533 0.82 CYP3A4 (0.64) CTSSCTSKBCHESIGMAR1L3MBTL1
SCHEMBL14416295 0.82 PSMB5 (0.48) CTSSCTSKL3MBTL1CTSBACE
SCHEMBL14027140 0.81 SIGMAR1 (0.55) CTSSCTSKSIGMAR1POLBACE
SCHEMBL27268141 0.81 HDAC3 (0.51) CTSSCTSKSIGMAR1L3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240209023-A1 PEPTIDE COMPOUND, APPLICATION THEREOF AND COMPOSITION CONTAINING SAME XDCEXPLORER (SHANGHAI) CO., LTD. (CN) 2024-06-27 — — 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-20240209023-A1 PEPTIDE COMPOUND, APPLICATION THEREOF AND COMPOSITION CONTAINING SAME VIP, NGLY1, FURIN CTSS 1347/4885CTSK 958/4885BCHE 271/4885

“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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