SCHEMBL24322731

SCHEMBL24322731

N=C(N)NCCC[C@H](N)C(=O)N1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 6/20 0.38
DPP9 Q86TI2 5/20 0.38
DPP7 Q9UHL4 12/20 0.37
DPP4 P27487 3/20 0.37
ARG1 P05089 1/20 0.36
ITGB3 P05106 2/20 0.35
ITGA2B P08514 2/20 0.35
F2 P00734 1/20 0.34
NRP1 O14786 2/20 0.33
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33

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
SCHEMBL15468396 0.92 DPP7 (0.36) DPP8DPP9DPP7DPP4F2
SCHEMBL24322781 0.86 DPP8 (0.44) DPP8DPP9DPP7DPP4ARG1
SCHEMBL10730573 0.86 DPP8 (0.44) DPP8DPP9DPP7DPP4ARG1
SCHEMBL24324302 0.83 DPP7 (0.38) DPP8DPP9DPP7DPP4ARG1
SCHEMBL24322721 0.83 GAA (0.47) DPP8DPP9DPP7DPP4ARG1
SCHEMBL11534938 0.83 GAA (0.47) DPP8DPP9DPP7DPP4ARG1
SCHEMBL27296297 0.83 ARG1 (0.35) DPP8DPP9DPP7DPP4ARG1
Arginine SCHEMBL27748019 0.81 OTC (0.49) ARG1
Arginine SCHEMBL18788608 0.81 OTC (0.49) ARG1
SCHEMBL15941314 0.80 NPY4R (0.33) DPP8DPP9DPP7DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof Psomagen Inc. (US) 2022-04-21 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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof HTRA1, GIPR, HPN DPP8 296/4885DPP9 138/4885DPP7 367/4885

“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.