SCHEMBL27207239

SCHEMBL27207239

CC(C)(C)OC(=O)NC(Cc1cc(Cl)cc(Br)c1O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.47
CTSK P43235 6/20 0.47
ACE P12821 2/20 0.47
SCN9A Q15858 1/20 0.46
PPARA Q07869 3/20 0.45
PPARG P37231 2/20 0.45
CTSL P07711 1/20 0.43
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43
GRN P28799 2/20 0.42
SORT1 Q99523 2/20 0.42
ITGA4 P13612 2/20 0.42
ITGB7 P26010 2/20 0.42
PTPN1 P18031 1/20 0.42
CTSB P07858 1/20 0.41
AAK1 Q2M2I8 1/20 0.40

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
SCHEMBL27203735 1.00 CTSS (0.47) CTSSCTSKACESCN9APPARA
SCHEMBL30825617 0.89 CTSS (0.44) CTSSCTSKACESCN9APPARA
SCHEMBL27207390 0.86 CTSS (0.47) CTSSCTSKACESCN9APPARA
SCHEMBL27203747 0.86 CTSS (0.47) CTSSCTSKACESCN9APPARA
SCHEMBL31276738 0.86 CTSS (0.53) CTSSCTSKACESCN9APPARA
SCHEMBL27207525 0.84 PPARA (0.47) CTSSCTSKACESCN9APPARA
SCHEMBL27203757 0.84 PPARA (0.47) CTSSCTSKACESCN9APPARA
SCHEMBL3956664 0.83 ACE (0.57) CTSSCTSKACEPPARAPPARG
SCHEMBL27203760 0.82 PPARA (0.51) CTSSCTSKACESCN9APPARA
SCHEMBL27207487 0.82 PPARA (0.51) CTSSCTSKACESCN9APPARA

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-20240132524-A1 SMALL MOLECULES FOR BORON NEUTRON CAPTURE THERAPY AVIKO RADIOPHARMACEUTICALS, LLC 2024-04-25 US disclosed
WO-2024064210-A1 SMALL MOLECULES FOR BORON NEUTRON CAPTURE THERAPY AVIKO RADIOPHARMACEUTICALS, LLC (US) 2024-03-28 WO 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-20240132524-A1 SMALL MOLECULES FOR BORON NEUTRON CAPTURE THERAPY NME2, BTD, BLVRB CTSS 1784/4885CTSK 1803/4885ACE 4079/4885

“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.