SCHEMBL1369617

SCHEMBL1369617

C[C@H](N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP3 Q9NY33 5/20 0.53
▸ CAPN1 P07384 2/20 0.53
▸ CTSB P07858 2/20 0.53
▸ OPRM1 P35372 1/20 0.51
▸ CCKBR P32239 1/20 0.49
▸ DPP4 P27487 1/20 0.49
▸ ECE1 P42892 1/20 0.48
▸ CXCR4 P61073 2/20 0.47

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
SCHEMBL30005150 1.00 DPP3 (0.53) DPP3CAPN1CTSBOPRM1CCKBR
SCHEMBL1369614 1.00 DPP3 (0.53) DPP3CAPN1CTSBOPRM1CCKBR
SCHEMBL29565313 0.86 DPP3 (0.58) DPP3CAPN1CTSBOPRM1CCKBR
SCHEMBL30052964 0.85 DPP3 (0.69) DPP3CAPN1CTSBDPP4
SCHEMBL19443228 0.82 CAPN1 (0.59) DPP3CAPN1CTSBOPRM1DPP4
SCHEMBL31396846 0.80 DPP3 (0.56) DPP3CAPN1CTSB
SCHEMBL31091345 0.80 DPP3 (0.57) DPP3OPRM1
SCHEMBL29498112 0.80 DPP4 (0.65) DPP3DPP4
SCHEMBL31127569 0.79 NTSR2 (0.54) DPP3DPP4CXCR4
SCHEMBL12890870 0.79 CXCR4 (0.54) OPRM1CCKBRCXCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160263235-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC (CA) 2016-09-15 — — US disclosed
EP-2794663-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF Angiochem Inc. (CA) 2014-10-29 — — EP disclosed
US-20110288011-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC. (CA) 2011-11-24 — — US disclosed
WO-2010063124-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC. (CA) 2010-06-10 — — WO 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 (2 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-20160263235-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF VIP, SLC1A5, SLC47A1 DPP3 370/4885CAPN1 2308/4885CTSB 160/4885
US-20110288011-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF VIP, SLC1A5, SLC47A1 DPP3 370/4885CAPN1 2308/4885CTSB 160/4885

“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.

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