SCHEMBL29929342

SCHEMBL29929342

O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)CN1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.60
CYP19A1 P11511 6/20 0.56
MMP3 P08254 1/20 0.48
MMP8 P22894 1/20 0.48
DRD5 P21918 1/20 0.46

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
SCHEMBL799730 1.00 ACE (0.60) ACECYP19A1MMP3MMP8DRD5
SCHEMBL9038284 0.83 ACE (0.64) ACECYP19A1MMP3MMP8
SCHEMBL6761709 0.83 ACE (0.64) ACECYP19A1MMP3MMP8
SCHEMBL9036399 0.83 ACE (0.64) ACECYP19A1MMP3MMP8
SCHEMBL30471119 0.79 ACE (0.72) ACECYP19A1MMP3MMP8DRD5
SCHEMBL677552 0.79 ACE (0.67) ACECYP19A1MMP3MMP8DRD5
SCHEMBL8243497 0.79 ACE (0.67) ACECYP19A1MMP3MMP8DRD5
SCHEMBL5880416 0.79 ACE (0.67) ACECYP19A1MMP3MMP8DRD5
SCHEMBL29666098 0.79 ACE (0.67) ACECYP19A1MMP3MMP8DRD5
SCHEMBL1137272 0.78 FABP5 (0.46) ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250296955-A1 PIN1 TARGETING COMPOUNDS AND DEGRADERS AND METHODS THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-09-25 US disclosed
CN-112279888-B Polypeptide inhibitor of APC/Asef interaction and application thereof 上海交通大学医学院 2022-09-13 CN 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-20250296955-A1 PIN1 TARGETING COMPOUNDS AND DEGRADERS AND METHODS THEREOF PIN1, MDM2, XIAP ACE 1209/4885CYP19A1 1307/4885MMP3 795/4885

“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.