SCHEMBL5314701

SCHEMBL5314701

Cn1nnc([C@@H]2CCCN2)n1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
TAAR1 Q96RJ0 1/20 0.38
CHRM2 P08172 3/20 0.34
CHRM4 P08173 2/20 0.34
CHRM5 P08912 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34

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
SCHEMBL13246614 1.00 L3MBTL1 (0.43) L3MBTL1TAAR1CHRM2CHRM4CHRM5
SCHEMBL13246595 1.00 L3MBTL1 (0.43) L3MBTL1TAAR1CHRM2CHRM4CHRM5
SCHEMBL5315145 0.79 L3MBTL1 (0.38) L3MBTL1TAAR1CHRNA7
SCHEMBL5315676 0.78 L3MBTL1 (0.37) L3MBTL1TAAR1CHRM2CHRNB2CHRNA7
SCHEMBL13246612 0.78 L3MBTL1 (0.37) L3MBTL1TAAR1CHRM2CHRM4CHRM5
SCHEMBL2989002 0.78 TAAR1 (0.39) L3MBTL1TAAR1CHRM2CHRM4CHRM5
SCHEMBL2999926 0.78 L3MBTL1 (0.37) L3MBTL1TAAR1CHRM2CHRM4CHRM5
SCHEMBL2989005 0.78 TAAR1 (0.39) L3MBTL1TAAR1CHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL2985980 0.77 L3MBTL1 (0.39) L3MBTL1TAAR1CHRM2CHRM4CHRM5
SCHEMBL27853058 0.74 POLB (0.35) TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338620-B2 Methods for the production of C-8 lactam lactone compounds NOVARTIS AG (CH) 2012-12-25 US disclosed
US-20100184991-A1 PREPARATION OF TERAZOLE DERIVATIVES SEDELMEIER GOTTFRIED 2010-07-22 US disclosed
US-20100184991-A1 PREPARATION OF TERAZOLE DERIVATIVES SEDELMEIER GOTTFRIED 2010-07-22 US disclosed
US-20080200687-A1 Preparation of Terazole Derivatives SEDELMEIER GOTTFRIED 2008-08-21 US disclosed
US-20080200687-A1 Preparation of Terazole Derivatives SEDELMEIER GOTTFRIED 2008-08-21 US disclosed
WO-2007067904-A2 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-06-14 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 (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-20080200687-A1 Preparation of Terazole Derivatives TERB1, TALDO1, TERT L3MBTL1 2483/4885TAAR1 985/4885CHRM2 1270/4885
US-20100184991-A1 PREPARATION OF TERAZOLE DERIVATIVES TERB1, TALDO1, TERT L3MBTL1 2483/4885TAAR1 985/4885CHRM2 1270/4885

“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.