SCHEMBL21315780

SCHEMBL21315780

COC(=O)C(Cc1nn(C(=O)O)c2ccccc12)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.47
▸ TP53 P04637 3/20 0.47
▸ CASP3 P42574 1/20 0.44
▸ MDM2 Q00987 5/20 0.44

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
SCHEMBL21315777 1.00 MDM4 (0.47) MDM4TP53CASP3MDM2
SCHEMBL19815178 0.83 MDM4 (0.49) MDM4TP53CASP3MDM2
SCHEMBL19815176 0.83 MDM4 (0.49) MDM4TP53CASP3MDM2
SCHEMBL29401932 0.79 ATM (0.53) MDM4TP53CASP3
SCHEMBL13743302 0.79 ATM (0.53) MDM4TP53CASP3
SCHEMBL2977877 0.79 ATM (0.53) MDM4TP53CASP3
SCHEMBL12531899 0.79 ATM (0.53) MDM4TP53CASP3
SCHEMBL29400163 0.78 CASP3 (0.61) MDM4TP53CASP3MDM2
SCHEMBL13163900 0.78 CASP3 (0.61) MDM4TP53CASP3MDM2
SCHEMBL28641187 0.78 CASP3 (0.61) MDM4TP53CASP3MDM2

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-20190270778-A1 Cyclic Peptides As C5a Receptor Antagonists PFIZER INC. (US) 2019-09-05 — — 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-20190270778-A1 Cyclic Peptides As C5a Receptor Antagonists C3AR1, C5AR1, C5AR2 MDM4 4574/4885TP53 2460/4885CASP3 3437/4885

“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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