SCHEMBL24322784

SCHEMBL24322784

C[C@@H]1CCN(C(=O)[C@@H](N)CC(=O)NC[C@@H]2CCCN(C(=N)N)C2)[C@@H](C(=O)O)C1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F2 P00734 12/20 0.62
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
TPSAB1 Q15661 1/20 0.35
CPN1 P15169 1/20 0.34
CPB2 Q96IY4 1/20 0.34
REN P00797 1/20 0.34

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
SCHEMBL24322793 0.89 F2 (0.62) F2DPP4DPP8TPSAB1
SCHEMBL24322770 0.80 F2 (0.56) F2DPP4DPP8TPSAB1CPN1
SCHEMBL7391125 0.80 F2 (0.56) F2DPP4DPP8TPSAB1CPN1
SCHEMBL24322551 0.80 F2 (0.59) F2DPP4DPP8TPSAB1CPN1
Hydrochloric Acid SCHEMBL9003170 0.79 F2 (0.56) F2TPSAB1CPN1CPB2
Acetic Acid SCHEMBL8918912 0.77 F2 (0.97) F2
SCHEMBL24322799 0.77 F2 (0.58) F2TPSAB1CPN1CPB2
SCHEMBL24324301 0.74 F2 (0.43) F2TPSAB1CPN1CPB2
SCHEMBL24323889 0.73 F2 (0.61) F2TPSAB1
SCHEMBL7390858 0.72 F2 (0.43) F2TPSAB1CPN1CPB2

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 F2 3514/4885DPP4 532/4885DPP8 296/4885

“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.