SCHEMBL10074733

SCHEMBL10074733

COc1ccc(COCC(NC(=O)C(C)(C)C)C(OCc2ccc(OC)cc2)C(=O)NCC(C)(C)CNC(=O)CC(Cc2cc(F)ccc2F)NC(=O)C(C)(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.33
REN P00797 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
DPP4 P27487 4/20 0.32
MMEL1 Q495T6 1/20 0.31
KCNH2 Q12809 3/20 0.31
FAP Q12884 3/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PREP P48147 1/20 0.31
DPP9 Q86TI2 1/20 0.31
FFAR1 O14842 1/20 0.30
ENPP2 Q13822 1/20 0.30

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
SCHEMBL10074286 1.00 CTSD (0.33) CTSDRENKMT2AMEN1DPP4
SCHEMBL10078388 1.00 CTSD (0.33) CTSDRENKMT2AMEN1DPP4
SCHEMBL10074725 0.85 CTSS (0.35) CTSDRENDPP4
SCHEMBL10074317 0.84 CTSS (0.35) CTSDRENDPP4
SCHEMBL10078386 0.84 CTSS (0.35) CTSDRENDPP4
SCHEMBL10074284 0.84 CTSS (0.35) CTSDRENDPP4
SCHEMBL10075282 0.83 CACNA1B (0.36) CTSDREN
SCHEMBL10077515 0.83 CACNA1B (0.36) CTSDREN
SCHEMBL10077081 0.82 DPP4 (0.39) RENDPP4KCNH2FAPPREP
SCHEMBL10074143 0.81 CACNA1B (0.36) CTSDREN

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 54/4885REN 449/4885KMT2A 4300/4885

“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.