SCHEMBL10074273

SCHEMBL10074273

CCCCCCNC(CC(=O)NCC(C)(C)CNC(=O)C(O)C(COCc1ccccc1)NCCCCCC)Cc1cc(F)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSD P07339 6/20 0.33
CTSS P25774 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
REN P00797 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TLR2 O60603 1/20 0.31
CTSB P07858 1/20 0.31
TAOK1 Q7L7X3 1/20 0.31
TAOK3 Q9H2K8 1/20 0.31
ENPP2 Q13822 1/20 0.31

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
SCHEMBL10074152 0.92 DPP4 (0.36) CTSDCTSSMEN1KMT2AREN
SCHEMBL10074717 0.92 REN (0.35) CTSSRENTLR2
SCHEMBL6872783 0.92 CTSD (0.34) CTSDTLR2ENPP2
SCHEMBL10074455 0.88 ENPP2 (0.39) CTSSENPP2
SCHEMBL10074987 0.88 ENPP2 (0.39) CTSSENPP2
SCHEMBL10074154 0.87 ENPP2 (0.38) CTSDCTSSENPP2
SCHEMBL10074135 0.85 CTSS (0.35) CTSDCTSSCTSB
SCHEMBL10078263 0.84 CTSS (0.35) CTSDCTSSRENCTSB
SCHEMBL10078261 0.84 PSMB11 (0.38) CTSDCTSSRENCTSB
SCHEMBL10078386 0.83 CTSS (0.35) CTSDCTSSRENCTSB

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
EP-2418196-A1 Dual alanyl-aminopeptidase and dipeptidyl-peptidase IV inhibitors IMTM GmbH (DE) 2012-02-15 EP disclosed
US-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS IMTM GMBH (DE) 2012-02-02 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-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS SERPINB1, CMA1, CPA3 CTSD 54/4885CTSS 43/4885MEN1 3747/4885

“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.