SCHEMBL4955491

SCHEMBL4955491

C[C@H](NNC1CCCCN1C(=O)O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.33
▸ PREP P48147 1/20 0.33
▸ FAP Q12884 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ REN P00797 2/20 0.32
▸ ACE P12821 3/20 0.32

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
SCHEMBL4954448 0.83 ALDH1A1 (0.35) PREPALDH1A1HSD17B10DPP4CYP3A4
SCHEMBL4955392 0.78 ALDH1A1 (0.37) ALDH1A1HSD17B10ACE
SCHEMBL15392569 0.75 HPGD (0.37) ALDH1A1HSD17B10
SCHEMBL29588126 0.72 HTT (0.37) FAPALDH1A1HSD17B10DPP4
SCHEMBL15414815 0.71 RIPK1 (0.36) ALDH1A1HSD17B10DPP4
SCHEMBL2732689 0.71 HPGD (0.38) ALDH1A1HSD17B10DPP4
SCHEMBL5856782 0.71 CPN1 (0.36) —
SCHEMBL21293929 0.70 DPP4 (0.40) PREPFAPDPP4
SCHEMBL4955982 0.70 BBOX1 (0.35) PREPFAPDPP4
Hydrochloric Acid SCHEMBL895282 0.70 RIPK1 (0.36) ALDH1A1HSD17B10DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7439226-B2 Serine protease inhibitors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2008-10-21 — — US disclosed
WO-2006043933-A1 SERINE PROTEASE INHIBITORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-04-27 — — WO disclosed
US-20050130883-A1 Serine protease inhibitors THE GOV. OF THE USA AS REPRESENTED BY THE SECRETARY OF THE DEPT. OF HEALTH & HUMAN SERVICES 2005-06-16 — — 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-20050130883-A1 Serine protease inhibitors PRSS1, TASP1, METAP1 LTA4H 1884/4885PREP 51/4885FAP 165/4885

“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.

Send feedback