SCHEMBL5498787

SCHEMBL5498787

NCCC[N]C(=O)[C@@H]1CCCN1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.40
DPP8 Q6V1X1 4/20 0.40
DPP9 Q86TI2 4/20 0.40
NOS2 P35228 2/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
PRCP P42785 2/20 0.38
DPP7 Q9UHL4 2/20 0.34
GLI1 P08151 1/20 0.33
FAP Q12884 1/20 0.33
ARG1 P05089 1/20 0.32
ARG2 P78540 1/20 0.32
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
SCN4A P35499 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
SCHEMBL5498784 1.00 DPP4 (0.40) DPP4DPP8DPP9NOS2NOS3
SCHEMBL5493696 0.90 NOS2 (0.41) DPP4DPP8DPP9NOS2NOS3
D-Proline SCHEMBL5898607 0.74 PRCP (0.44) DPP4DPP8DPP9NOS2NOS3
SCHEMBL15457829 0.70
SCHEMBL6689415 0.70
SCHEMBL12020146 0.70
SCHEMBL8548319 0.70 PRCP (0.68) NOS2PRCPDPP7HTR2CHTR2B
SCHEMBL5498791 0.70 PRCP (0.68) NOS2PRCPDPP7HTR2CHTR2B
SCHEMBL1969954 0.69 NOS2 (0.45) DPP4DPP8DPP9NOS2NOS3
SCHEMBL15360284 0.69 NOS2 (0.45) DPP4DPP8DPP9NOS2NOS3

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
EP-1100816-B1 AEROTHRICIN ANALOGS, THEIR PREPARATION AND USE BASILEA PHARMACEUTICA AG (CH) 2007-08-08 EP disclosed
EP-1251827-B1 NASALLY ADMINISTRABLE ANTIFUNGAL CYCLIC PEPTIDE COMPOSITIONS BASILEA PHARMACEUTICA AG (CH) 2004-05-26 EP disclosed
US-6489440-B1 Cyclic compounds BASILEA PHARMACEUTICA AG (CH) 2002-12-03 US disclosed
US-20010038824-A1 Intranasal cyclic peptide formulations BASILEA PHARMACEUTICA AG (CH) 2001-11-08 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-20010038824-A1 Intranasal cyclic peptide formulations VIP, NPPA, SSTR5 DPP4 2181/4885DPP8 1929/4885DPP9 1560/4885

“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.