SCHEMBL14770252

SCHEMBL14770252

COC(=O)[C@@H]1CC(=O)CN1P

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.58
ANPEP P15144 4/20 0.58
BRD4 O60885 1/20 0.40
CYP1A2 P05177 1/20 0.34
HIF1A Q16665 1/20 0.34
ALDH1A1 P00352 1/20 0.33
FKBP1A P62942 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
CYP19A1 P11511 3/20 0.32
KMT2A Q03164 1/20 0.31

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
SCHEMBL15083833 0.80 MMP2 (0.57) MMP2ANPEPBRD4CYP1A2HIF1A
SCHEMBL201253 0.80 MMP2 (0.57) MMP2ANPEPBRD4CYP1A2HIF1A
SCHEMBL13403397 0.79 MMP2 (0.60) MMP2ANPEPBRD4CYP1A2HIF1A
SCHEMBL2691165 0.79 MMP2 (0.60) MMP2ANPEPBRD4CYP1A2HIF1A
SCHEMBL17973099 0.79 MMP2 (0.60) MMP2ANPEPBRD4CYP1A2HIF1A
SCHEMBL13998788 0.79 MMP2 (0.39) MMP2ANPEP
SCHEMBL8404107 0.76 MMP2 (0.57) MMP2ANPEPBRD4ALDH1A1CYP19A1
SCHEMBL8404080 0.76 MMP2 (0.57) MMP2ANPEPBRD4ALDH1A1CYP19A1
SCHEMBL8404149 0.76 MMP2 (0.57) MMP2ANPEPBRD4CYP1A2HIF1A
SCHEMBL3973783 0.76 MMP2 (0.57) MMP2ANPEPBRD4CYP1A2HIF1A

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-9512074-B2 Radiolabeled inhibitors of the amino acid transporters ASCT1 and ASCT2 THE UNIVERSITY OF MONTANA (US) 2016-12-06 US disclosed
US-20150056138-A1 Radiolabeled Inhibitors of the Amino Acid Transporters ASCT1 and ASCT2 THE UNIVERSITY OF MONTANA 2015-02-26 US disclosed
US-8895607-B2 Inhibitors of the amino acid transporters ASCT1 and ASCT2 THE UNIVERSITY OF MONTANA (US) 2014-11-25 US disclosed
US-20130065935-A1 Novel Inhibitors of the Amino Acid Transporters ASCT1 and ASCT2 THE UNIVERSITY OF MONTANA 2013-03-14 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 (2 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-20130065935-A1 Novel Inhibitors of the Amino Acid Transporters ASCT1 and ASCT2 SLC1A2, SLC1A1, SLC1A3 MMP2 4476/4885ANPEP 476/4885BRD4 4694/4885
US-20150056138-A1 Radiolabeled Inhibitors of the Amino Acid Transporters ASCT1 and ASCT2 SLC1A2, SLC1A1, SLC1A3 MMP2 4453/4885ANPEP 439/4885BRD4 4757/4885

“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.