SCHEMBL6874198

SCHEMBL6874198

CC(C(=O)NCC(C)(C)CNC(=O)C(O)C(N)Cc1ccccc1)C(N)Cc1cc(F)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 4/20 0.48
ANPEP P15144 1/20 0.48
RNPEP Q9H4A4 1/20 0.48
DNPEP Q9ULA0 1/20 0.48
REN P00797 2/20 0.40
DPP4 P27487 5/20 0.39
DPP7 Q9UHL4 5/20 0.39
DPP9 Q86TI2 3/20 0.39
PSMB5 P28074 2/20 0.37
LTA4H P09960 1/20 0.37
RORC P51449 1/20 0.37
METAP2 P50579 2/20 0.36
DPP8 Q6V1X1 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 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
SCHEMBL10074711 0.90 REN (0.39) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL6873519 0.88 LAP3 (0.44) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL6873741 0.87 LAP3 (0.44) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL6873681 0.87 LAP3 (0.44) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL6877799 0.87 LAP3 (0.44) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL10077380 0.84 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL10074491 0.83 LAP3 (0.41) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL13194683 0.83 LAP3 (0.41) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL6872762 0.82 LAP3 (0.40) LAP3ANPEPRNPEPDNPEPREN
SCHEMBL6874066 0.82 LAP3 (0.44) LAP3ANPEPRNPEPDNPEPREN

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-20120258960-A1 NOVEL MULTIFUNCTIONAL PEPTIDASE INHIBITORS, ESPECIALLY FOR MEDICAL USE IMTM GMBH (DE) 2012-10-11 US disclosed
WO-2011026781-A1 NOVEL MULTIFUNCTIONAL PEPTIDASE INHIBITORS, ESPECIALLY FOR MEDICAL USE IMTM GMBH (DE) 2011-03-10 WO disclosed
EP-2292589-A1 Novel multifunctional peptidase inhibitors, especially for medical use IMTM GmbH (DE) 2011-03-09 EP 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-20120258960-A1 NOVEL MULTIFUNCTIONAL PEPTIDASE INHIBITORS, ESPECIALLY FOR MEDICAL USE PEPD, CTSC, SERPINB1 LAP3 88/4885ANPEP 13/4885RNPEP 29/4885

“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.