SCHEMBL10074161

SCHEMBL10074161

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

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.46
CHRNB2 P17787 2/20 0.40
CHRNB4 P30926 2/20 0.40
CHRNA3 P32297 2/20 0.40
CHRNA4 P43681 2/20 0.40
SRC P12931 1/20 0.39
DPP4 P27487 2/20 0.38
DPP7 Q9UHL4 2/20 0.38
DPP9 Q86TI2 1/20 0.38
LAP3 P28838 2/20 0.37
ANPEP P15144 1/20 0.37
RNPEP Q9H4A4 1/20 0.37
DNPEP Q9ULA0 1/20 0.37
MAPT P10636 1/20 0.37
GRIA1 P42261 1/20 0.36
PYGL P06737 1/20 0.35

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
SCHEMBL10074349 0.88 MMP2 (0.50) MMP2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL10074145 0.88 MMP2 (0.50) MMP2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL10078080 0.88 DPP4 (0.38) MMP2DPP4DPP7DPP9LAP3
SCHEMBL10074160 0.86 DPP4 (0.36) MMP2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL10074474 0.82 ATM (0.43)
SCHEMBL10074341 0.82 ATM (0.43)
SCHEMBL10074304 0.76 ATM (0.41)
SCHEMBL10077474 0.76 ATM (0.40)
SCHEMBL10077078 0.75 LAP3 (0.45) MMP2DPP4DPP7DPP9LAP3
SCHEMBL10078089 0.75 LAP3 (0.45) MMP2DPP4DPP7DPP9LAP3

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 MMP2 17/4885CHRNB2 3717/4885CHRNB4 3969/4885

“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.