SCHEMBL4570558

SCHEMBL4570558

Nc1ccn(C2OC(COC(=O)c3ccccc3)C(OC(=O)c3ccccc3)C2[18F])c(=O)n1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
USP2 O75604 1/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
THRB P10828 1/20 0.47
MTOR P42345 1/20 0.47
MDM2 Q00987 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
ST6GAL1 P15907 3/20 0.45
HTT P42858 1/20 0.43
GAPDH P04406 2/20 0.43
HRAS P01112 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
SCHEMBL16556343 1.00 MEN1 (0.52) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL26647521 1.00 MEN1 (0.52) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL6765430 0.91 MEN1 (0.59) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL8516844 0.91 MEN1 (0.59) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL14011209 0.91 MEN1 (0.59) MEN1USP2POLBKMT2AALDH1A1
Hydrochloric Acid SCHEMBL11628090 0.90 MEN1 (0.58) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL28197797 0.89 LMNA (0.55) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL18271847 0.88 MEN1 (0.54) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL16947995 0.88 POLB (0.54) MEN1USP2POLBKMT2AALDH1A1
SCHEMBL1525218 0.88 ALDH1A1 (0.56) ALDH1A1LMNATHRBMTORMDM2

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-9481705-B2 Modular radiochemistry synthesis system THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-11-01 US disclosed
US-20160130295-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-12 US disclosed
US-20150329583-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM ENERGY, UNITED STATES DEPARTMENT OF 2015-11-19 US disclosed
US-20120107175-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM THE REGENTS OF THE UNIVERISTY OF CALIFORNIA (US) 2012-05-03 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-20160130295-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM RAD18, MVD, USP18 MEN1 669/4885USP2 538/4885POLB 416/4885
US-20150329583-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM RAD18, MVD, USP18 MEN1 669/4885USP2 538/4885POLB 416/4885

“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.