SCHEMBL22387822

SCHEMBL22387822

NNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)N1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 4/20 0.39
▸ CTSB P07858 4/20 0.39
▸ CTSS P25774 12/20 0.39
▸ PKM P14618 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TACR2 P21452 2/20 0.35
▸ CTSK P43235 2/20 0.34
▸ CTSH P09668 1/20 0.34
▸ CTSC P53634 1/20 0.34
▸ PSMB11 A5LHX3 1/20 0.34
▸ PSMA7 O14818 1/20 0.34
▸ PSMB1 P20618 1/20 0.34
▸ PSMA1 P25786 1/20 0.34
▸ PSMA2 P25787 1/20 0.34
▸ PSMA3 P25788 1/20 0.34
▸ PSMA4 P25789 1/20 0.34
▸ PSMB8 P28062 1/20 0.34
▸ PSMB9 P28065 1/20 0.34
▸ PSMA5 P28066 1/20 0.34
▸ PSMB4 P28070 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
SCHEMBL7908157 0.92 CTSL (0.39) CTSLCTSBCTSSPKMSMN1; SMN2
SCHEMBL26019659 0.92 CTSL (0.39) CTSLCTSBCTSSPKMSMN1; SMN2
SCHEMBL1562598 0.82 POLB (0.44) CTSLCTSBCTSSPKMSMN1; SMN2
SCHEMBL1562599 0.82 POLB (0.44) CTSLCTSBCTSSPKMSMN1; SMN2
SCHEMBL7441871 0.81 CTSS (0.53) CTSLCTSBCTSSTACR2CTSK
SCHEMBL9417266 0.81 CTSS (0.53) CTSLCTSBCTSSTACR2CTSK
SCHEMBL22387819 0.81 CTSS (0.40) CTSLCTSBCTSSCTSKCTSH
SCHEMBL10555105 0.81 CTSL (0.56) CTSLCTSBCTSSTACR2CTSK
SCHEMBL26019657 0.79 CTSS (0.40) CTSLCTSBCTSSCTSKCTSH
SCHEMBL2623712 0.77 APLNR (0.40) CTSLCTSBCTSSCTSKCTSH

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-20200277647-A1 CHEMILUMINESCENT PROBES FOR IMAGING/DETECTION OF PROTEASES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2020-09-03 — — 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-20200277647-A1 CHEMILUMINESCENT PROBES FOR IMAGING/DETECTION OF PROTEASES ADAM12, ADAM17, PRCP CTSL 137/4885CTSB 116/4885CTSS 185/4885

“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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