SCHEMBL6673476

SCHEMBL6673476

CC(NC(=O)OCC1c2ccccc2-c2ccccc21)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
EPHX2 P34913 1/20 0.51
CASP3 P42574 2/20 0.48
MDM4 O15151 2/20 0.48
TP53 P04637 2/20 0.48
FABP5 Q01469 3/20 0.47
FABP7 O15540 2/20 0.47

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
SCHEMBL7545706 0.94 KMT2A (0.49) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL29362505 0.89 KMT2A (0.54) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL119779 0.89 KMT2A (0.54) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL29503775 0.89 KMT2A (0.54) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL6647665 0.88 KMT2A (0.53) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL30809552 0.88 KMT2A (0.53) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL10205819 0.87 KMT2A (0.58) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL12560390 0.86 KMT2A (0.52) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL8687186 0.86 KMT2A (0.52) KMT2AEPHX2CASP3MDM4TP53
SCHEMBL1880388 0.86 KMT2A (0.55) KMT2AEPHX2CASP3MDM4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150374861-A1 KIT FOR TUMOR IMAGING THOMAS JEFFERSON UNIVERSITY 2015-12-31 US disclosed
EP-2956157-A1 KIT FOR TUMOR IMAGING Thomas Jefferson University (US) 2015-12-23 EP disclosed
WO-2014126902-A1 KIT FOR TUMOR IMAGING THOMAS JEFFERSON UNIVERSITY (US) 2014-08-21 WO disclosed
WO-2004031220-A1 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-04-15 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-20150374861-A1 KIT FOR TUMOR IMAGING ARG1, TIE1, TYR KMT2A 195/4885EPHX2 3912/4885CASP3 3369/4885

“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.