SCHEMBL14765263

SCHEMBL14765263

O=C(N[C@@H](CSC[C@H](O)CO)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC17A5 Q9NRA2 1/20 0.56
MDM4 O15151 3/20 0.53
TP53 P04637 3/20 0.53
CASP3 P42574 2/20 0.48
TLR2 O60603 2/20 0.47
MDM2 Q00987 5/20 0.47
KMT2A Q03164 2/20 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
SCHEMBL888345 1.00 SLC17A5 (0.56) SLC17A5MDM4TP53CASP3TLR2
SCHEMBL2419146 1.00 SLC17A5 (0.56) SLC17A5MDM4TP53CASP3TLR2
SCHEMBL19888241 0.90 SLC17A5 (0.58) SLC17A5MDM4TP53CASP3TLR2
SCHEMBL161752 0.87 MDM4 (0.47) SLC17A5MDM4TP53CASP3MDM2
SCHEMBL161749 0.87 MDM4 (0.47) SLC17A5MDM4TP53CASP3MDM2
SCHEMBL161751 0.87 MDM4 (0.47) SLC17A5MDM4TP53CASP3MDM2
SCHEMBL161750 0.87 MDM4 (0.47) SLC17A5MDM4TP53CASP3MDM2
SCHEMBL14765032 0.87 MDM4 (0.47) SLC17A5MDM4TP53CASP3MDM2
SCHEMBL29386847 0.86 SLC17A5 (0.44) SLC17A5MDM4TP53CASP3KMT2A
SCHEMBL1486194 0.86 SLC17A5 (0.58) SLC17A5MDM4TP53CASP3TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11458212-B2 Molecular imaging of cancer cells in vivo H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2022-10-04 US disclosed
US-20200164093-A1 Molecular Imaging of Cancer Cells In Vivo H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2020-05-28 US disclosed
US-10406248-B2 Molecular imaging of cancer cells in vivo H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2019-09-10 US disclosed
US-20140161725-A1 Molecular Imaging of Cancer Cells In Vivo ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2014-06-12 US disclosed
US-20140161725-A1 Molecular Imaging of Cancer Cells In Vivo ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2014-06-12 US disclosed
US-20140161725-A1 Molecular Imaging of Cancer Cells In Vivo ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2014-06-12 US disclosed
WO-2013036543-A2 MOLECULAR IMAGING OF CANCER CELLS IN VIVO H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2013-03-14 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 (4 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-20140161725-A1 Molecular Imaging of Cancer Cells In Vivo MKI67, ANXA4, ANXA3 SLC17A5 445/4885MDM4 481/4885TP53 6/4885
US-11458212-B2 Molecular imaging of cancer cells in vivo MKI67, ANXA4, ANXA3 SLC17A5 445/4885MDM4 481/4885TP53 6/4885
US-10406248-B2 Molecular imaging of cancer cells in vivo MKI67, ANXA4, ANXA3 SLC17A5 445/4885MDM4 481/4885TP53 6/4885
US-20200164093-A1 Molecular Imaging of Cancer Cells In Vivo MKI67, ANXA4, ANXA3 SLC17A5 445/4885MDM4 481/4885TP53 6/4885

“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.