SCHEMBL3796192

SCHEMBL3796192

CNC(C)C(=O)NC(C(=O)N1CCCC1C(=O)O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.50
REN P00797 4/20 0.50
KDM4E B2RXH2 1/20 0.50
F2 P00734 1/20 0.50
LMNA P02545 1/20 0.50
LTA4H P09960 1/20 0.50
MAPT P10636 1/20 0.50
PEPD P12955 1/20 0.50
ALOX15 P16050 1/20 0.50
PTGS1 P23219 1/20 0.50
HTR2A P28223 1/20 0.50
PTGS2 P35354 1/20 0.50
HRH1 P35367 1/20 0.50
THPO P40225 1/20 0.50
PMP22 Q01453 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ACE2 Q9BYF1 1/20 0.50
BIRC2 Q13490 1/20 0.49
XIAP P98170 1/20 0.48
MLX Q9UH92 1/20 0.48

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
SCHEMBL13673006 0.87 BIRC2 (0.49) PEPDBIRC2XIAPMLXDPP4
SCHEMBL17305538 0.86 DPP4 (0.61) ACERENKDM4EF2LMNA
SCHEMBL30534327 0.86 DPP4 (0.61) ACERENKDM4EF2LMNA
SCHEMBL6978337 0.86 DPP4 (0.61) ACERENKDM4EF2LMNA
SCHEMBL30052033 0.85 ACE (0.51) ACERENKDM4EF2LMNA
SCHEMBL3722484 0.85 BIRC2 (0.50) ACERENKDM4EF2LMNA
SCHEMBL15064522 0.84 ACE (0.50) ACERENKDM4EF2LMNA
SCHEMBL15064524 0.84 ACE (0.50) ACERENKDM4EF2LMNA
SCHEMBL28554976 0.84 ACE (0.50) ACERENKDM4EF2LMNA
SCHEMBL30053268 0.84 ACE (0.50) ACERENKDM4EF2LMNA

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-20100190688-A1 Tetrapeptide analogs IDUN PHARMACEUTICALS, INC. 2010-07-29 US disclosed
US-7608577-B2 Peptidyl ketones as inhibitors of DPIV OSI PHARMACEUTICALS, INC. (US) 2009-10-27 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-20100190688-A1 Tetrapeptide analogs TP53, PCNA, HRAS ACE 3012/4885REN 2229/4885KDM4E 4215/4885

“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.