SCHEMBL11023355

SCHEMBL11023355

CN1CC(=O)Nc2ccc([N+](C)(C)C)cc2C1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
CRBN Q96SW2 4/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
DDB1 Q16531 2/20 0.36
BRD4 O60885 3/20 0.35
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
PGR P06401 1/20 0.32
GAA P10253 1/20 0.32
CREBBP Q92793 1/20 0.32
NPC1 O15118 1/20 0.32
CYP3A4 P08684 1/20 0.32
GRM5 P41594 1/20 0.32
RAB9A P51151 1/20 0.32
GRM1 Q13255 1/20 0.32
FTO Q9C0B1 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
EPHX2 P34913 1/20 0.30

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
SCHEMBL435141 0.81 MEN1 (0.70) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL29676340 0.80 KMT2A (0.68) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL7271469 0.80 KMT2A (1.00) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL11028170 0.80 MEN1 (0.73) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL2850811 0.80 MEN1 (0.68) MEN1KMT2APGRNPC1CYP3A4
SCHEMBL14114321 0.80 MEN1 (0.68) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL14610310 0.80 MEN1 (0.68) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL7138979 0.80 KMT2A (0.68) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL11027733 0.80 MEN1 (0.68) MEN1KMT2ACRBNCYP11B1CYP11B2
SCHEMBL11025336 0.78 MEN1 (0.65) MEN1KMT2ACRBNCYP11B1CYP11B2

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
EP-2486040-B1 AUTOMATED RADIOSYNTHESIS GE HEALTHCARE LTD (GB) 2017-06-21 EP disclosed
EP-2486040-B1 AUTOMATED RADIOSYNTHESIS GE HEALTHCARE LTD (GB) 2017-06-21 EP disclosed
US-8946410-B2 Automated radiosynthesis GE HEALTHCARE LIMITED (GB) 2015-02-03 US disclosed
US-20120190843-A1 AUTOMATED RADIOSYNTHESIS GE HEALTHCARE LIMITED (GB) 2012-07-26 US disclosed
WO-2011042529-A1 AUTOMATED RADIOSYNTHESIS GE HEALTHCARE LIMITED (GB) 2011-04-14 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 (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-20120190843-A1 AUTOMATED RADIOSYNTHESIS GABRB2, GABRB3, GABRR2 MEN1 2107/4885KMT2A 1636/4885CRBN 1115/4885

“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.