SCHEMBL13639719

SCHEMBL13639719

CC(C)(C)OC(=O)N[C@@H](C[C@H](Cc1ccc(OCc2ccccc2)cn1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.47
PTPN1 P18031 3/20 0.46
LTA4H P09960 1/20 0.45
PPARA Q07869 2/20 0.45
REN P00797 1/20 0.43
CTSS P25774 3/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSK P43235 1/20 0.43
POLB P06746 2/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ATM Q13315 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ACE P12821 1/20 0.42
EPHX2 P34913 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL13571255 0.90 PTPN1 (0.51) BCL2PTPN1PPARARENCTSS
SCHEMBL13571256 0.90 PTPN1 (0.51) BCL2PTPN1PPARARENCTSS
SCHEMBL13639674 0.87 BCL2 (0.58) BCL2PTPN1LTA4HPPARAREN
SCHEMBL16387557 0.87 BCL2 (0.58) BCL2PTPN1LTA4HPPARAREN
SCHEMBL1350878 0.86 PTPN1 (0.57) BCL2PTPN1PPARACTSSCTSL
SCHEMBL1350409 0.86 PTPN1 (0.57) BCL2PTPN1PPARACTSSCTSL
SCHEMBL13570708 0.85 ITGB3 (0.41) PTPN1CTSSCTSLCTSBCTSK
SCHEMBL13570709 0.85 ITGB3 (0.41) PTPN1CTSSCTSLCTSBCTSK
SCHEMBL16387458 0.85 ITGB3 (0.41) PTPN1CTSSCTSLCTSBCTSK
SCHEMBL13639642 0.85 ITGB3 (0.41) PTPN1CTSSCTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9238631-B2 Radiolabeled amino acids for diagnostic imaging PIRAMAL IMAGING SA (CH) 2016-01-19 US disclosed
US-9238631-B2 Radiolabeled amino acids for diagnostic imaging PIRAMAL IMAGING SA (CH) 2016-01-19 US disclosed
US-20150011773-A1 RADIOLABELED AMINO ACIDS FOR DIAGNOSTIC IMAGING PIRAMAL IMAGING SA (CH) 2015-01-08 US disclosed
US-20150011773-A1 RADIOLABELED AMINO ACIDS FOR DIAGNOSTIC IMAGING PIRAMAL IMAGING SA (CH) 2015-01-08 US disclosed
EP-2520556-A1 Radiolabeled amino acids for diagnostic imaging Bayer Pharma Aktiengesellschaft (DE) 2012-11-07 EP 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-20150011773-A1 RADIOLABELED AMINO ACIDS FOR DIAGNOSTIC IMAGING SLC1A5, SLC6A19, BCAT2 BCL2 4876/4885PTPN1 4784/4885LTA4H 2793/4885

“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.