SCHEMBL26328832

SCHEMBL26328832

C=CCOC(=O)[C@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ ABCB1 P08183 1/20 0.42
▸ MDM4 O15151 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ MDM2 Q00987 1/20 0.41
▸ CTSL P07711 1/20 0.41
▸ CTSK P43235 1/20 0.41

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
SCHEMBL20099715 1.00 PTPN1 (0.45) PTPN1ALDH1A1ABCB1MDM4TP53
SCHEMBL7973193 0.90 PTPN1 (0.45) PTPN1CASP3CTSLCTSK
SCHEMBL12052840 0.89 PTPN1 (0.48) PTPN1ALDH1A1ABCB1MDM4TP53
SCHEMBL8100860 0.89 PTPN1 (0.48) PTPN1ALDH1A1ABCB1MDM4TP53
SCHEMBL31714182 0.87 MDM4 (0.51) PTPN1ABCB1MDM4TP53CASP3
SCHEMBL117946 0.87 MDM4 (0.51) PTPN1ABCB1MDM4TP53CASP3
SCHEMBL119588 0.87 MDM4 (0.51) PTPN1ABCB1MDM4TP53CASP3
SCHEMBL16075059 0.87 PTPN1 (0.49) PTPN1ABCB1MDM4TP53MDM2
SCHEMBL14582839 0.87 EPHX2 (0.47) PTPN1ALDH1A1MDM4TP53CASP3
SCHEMBL29358863 0.87 MDM4 (0.51) PTPN1ABCB1MDM4TP53CASP3

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-11767354-B2 Antibody-coupled cyclic peptide tyrosine tyrosine compounds as modulators of neuropeptide Y receptors JANSSEN PHARMACEUTICA NV (BE) 2023-09-26 — — 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-11767354-B2 Antibody-coupled cyclic peptide tyrosine tyrosine compounds as modulators of neuropeptide Y receptors NPY1R, NPY5R, NPY2R PTPN1 54/4885ALDH1A1 4733/4885ABCB1 4323/4885

“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.

Send feedback