SCHEMBL13613735

SCHEMBL13613735

COC(=O)[C@H](CC(C)C)NCCC(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.44
CTSL P07711 2/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 2/20 0.38
TDP1 Q9NUW8 3/20 0.37
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.37
PSEN1 P49768 2/20 0.36
PSEN2 P49810 2/20 0.36
APH1B Q8WW43 2/20 0.36
NCSTN Q92542 2/20 0.36
APH1A Q96BI3 2/20 0.36
PSENEN Q9NZ42 2/20 0.36
CA12 O43570 2/20 0.36

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
SCHEMBL13613764 0.93 CAPN1 (0.44) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL4342005 0.88 CAPN1 (0.47) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL13613755 0.85 CA12 (0.44) CAPN1CTSSCTSKMEN1KMT2A
SCHEMBL7460122 0.85 CTSL (0.48) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL13900864 0.82 CTSK (0.48) CAPN1CTSSCTSKMEN1KMT2A
SCHEMBL2668380 0.80 CTSL (0.49) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL12880622 0.79 MEN1 (0.43) CAPN1CTSLCTSBCTSSCTSK
SCHEMBL16325790 0.77 BIRC2 (0.41) POLBFOLH1TAS1R3TAS1R1
SCHEMBL8535486 0.76 TDP1 (0.53) MEN1KMT2ANPSR1MAPTGAA
SCHEMBL7431545 0.76 TDP1 (0.44) CTSLCTSBCTSSCTSKNPSR1

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-20090275727-A1 Peptide turn mimetics MIMETICA PTY LIMITED (AU) 2009-11-05 US disclosed
US-20090275727-A1 Peptide turn mimetics MIMETICA PTY LIMITED (AU) 2009-11-05 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-20090275727-A1 Peptide turn mimetics IAPP, GLP1R, VIP CAPN1 4410/4885CTSL 436/4885CTSB 1186/4885

“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.