SCHEMBL23506296

SCHEMBL23506296

CC(C)C[C@H](NC(=O)c1cc2ccccc2s1)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)C(=O)NC1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
CTSK P43235 5/20 0.51
TAS1R3 Q7RTX0 2/20 0.47
TAS1R1 Q7RTX1 2/20 0.47

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
SCHEMBL23506252 0.96 CTSK (0.51) CTSLCTSBCTSKTAS1R3TAS1R1
SCHEMBL23506531 0.91 REN (0.45) CTSLCTSBCTSK
SCHEMBL21702046 0.91 REN (0.45) CTSLCTSBCTSK
SCHEMBL23506412 0.90 CTSL (0.45) CTSLCTSB
SCHEMBL23506250 0.89 CTSK (0.51) CTSLCTSBCTSKTAS1R3TAS1R1
SCHEMBL21702050 0.87 REN (0.44) CTSLCTSBCTSK
SCHEMBL23506329 0.87 CTSK (0.49) CTSLCTSBCTSK
SCHEMBL21702272 0.86 KLKB1 (0.43) CTSLCTSB
SCHEMBL23711577 0.86 CTSK (0.50) CTSLCTSBCTSKTAS1R3TAS1R1
SCHEMBL23506315 0.86 CTSK (0.50) CTSLCTSBCTSKTAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230133600-A1 PHARMACEUTICAL USE OF KETOAMIDE-BASED COMPOUND SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2023-05-04 US disclosed
EP-3835296-A1 KETOAMIDE COMPOUND AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2021-06-16 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 (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-20230133600-A1 PHARMACEUTICAL USE OF KETOAMIDE-BASED COMPOUND CTSL, CTSV, CTSS CTSL 1/4885CTSB 8/4885CTSK 13/4885

“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.