SCHEMBL3608181

SCHEMBL3608181

CON=C1CN(C(=O)O)CCC1(OC)OC

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 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
SCHEMBL3608179 1.00 MEN1 (0.30) MEN1CYP3A4MAPK1CYP2C19KMT2A
SCHEMBL3618965 0.77 CYP2C19 (0.33) MEN1CYP3A4MAPK1CYP2C19KMT2A
SCHEMBL12492770 0.72
SCHEMBL2908682 0.72
SCHEMBL3619719 0.68 CHRM2 (0.30)
SCHEMBL3621801 0.68 CHRM2 (0.30)
SCHEMBL28170910 0.64 CYP3A4 (0.34) MEN1CYP3A4MAPK1CYP2C19KMT2A
SCHEMBL3617624 0.64 CHRM2 (0.39) CYP3A4
SCHEMBL3617621 0.64 CHRM2 (0.39) CYP3A4
SCHEMBL4463404 0.63 CYP2C19 (0.33) MEN1CYP3A4MAPK1CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286181-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2010-11-11 US disclosed
EP-2064209-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY AstraZeneca AB (SE) 2009-06-03 EP disclosed
WO-2008020222-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2008-02-21 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-20100286181-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY PGLS, UROD, GMPS MEN1 3485/4885CYP3A4 607/4885MAPK1 2118/4885

“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.