SCHEMBL24668850

SCHEMBL24668850

N[C@@H](Cc1cnc[nH]1)c1noc(CNC(=O)N2CCC[C@@H]2C(=O)O)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.43
▸ TRHR P34981 1/20 0.41
▸ DPP7 Q9UHL4 1/20 0.40
▸ REN P00797 2/20 0.37
▸ PPM1B O75688 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ SLC7A5 Q01650 1/20 0.36
▸ PREP P48147 1/20 0.36
▸ ACE2 Q9BYF1 2/20 0.36
▸ LNPEP Q9UIQ6 1/20 0.34
▸ NLN Q9BYT8 2/20 0.34
▸ ALDH1A1 P00352 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
SCHEMBL21168269 0.83 LTA4H (0.47) CYP3A4ALDH1A1
SCHEMBL21168268 0.83 LTA4H (0.47) CYP3A4ALDH1A1
SCHEMBL21168333 0.81 REN (0.45) DPP4TRHRDPP7RENACE2
SCHEMBL21168281 0.81 REN (0.45) DPP4TRHRDPP7RENACE2
SCHEMBL18078245 0.80 REN (0.39) RENCYP3A4ACE2
SCHEMBL24058760 0.80 REN (0.39) RENCYP3A4ACE2
SCHEMBL21168328 0.80 ACE (0.43) DPP4DPP7RENCYP3A4ALDH1A1
SCHEMBL21168279 0.80 ACE (0.43) DPP4DPP7RENCYP3A4ALDH1A1
SCHEMBL21168332 0.79 ACE (0.35) RENCYP3A4ALDH1A1
SCHEMBL21168276 0.79 ACE (0.35) RENCYP3A4ALDH1A1

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-20220241248-A1 COMBINATION OF SMALL MOLECULE CD-47 INHIBITORS WITH OTHER ANTI-CANCER AGENTS AURIGENE ONCOLOGY LIMITED (IN) 2022-08-04 — — 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-20220241248-A1 COMBINATION OF SMALL MOLECULE CD-47 INHIBITORS WITH OTHER ANTI-CANCER AGENTS CD47, CD63, CD99 DPP4 4616/4885TRHR 2783/4885DPP7 4122/4885

“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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