SCHEMBL13613767

SCHEMBL13613767

C=CCOC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.56
CTSK P43235 4/20 0.52
CTSL P07711 2/20 0.52
CTSS P25774 2/20 0.52
CTSB P07858 1/20 0.52
CAPN1 P07384 1/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
AAK1 Q2M2I8 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.39

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
SCHEMBL27895527 0.85 SMN1; SMN2 (0.58) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL1701200 0.85 SMN1; SMN2 (0.58) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL15722121 0.84 SMN1; SMN2 (0.67) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL15722123 0.84 SMN1; SMN2 (0.57) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL701700 0.84 SMN1; SMN2 (0.57) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL4371611 0.84 SMN1; SMN2 (0.57) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL28968951 0.84 SMN1; SMN2 (0.57) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL28968948 0.84 SMN1; SMN2 (0.57) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL16130364 0.84 CTSL (0.48) SMN1; SMN2CTSKCTSLCTSSCTSB
SCHEMBL21675512 0.83 CTSK (0.61) CTSKCTSLCTSSCTSBCAPN1

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 SMN1; SMN2 3304/4885CTSK 1231/4885CTSL 436/4885

“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.