SCHEMBL1222210

SCHEMBL1222210

Cn1c(=O)n(CC(=O)c2ccccc2)c(=O)c2c1nc(N1CCC3CNCC31)n2Cc1cc(F)c(F)cc1F

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.74
LMNA P02545 1/20 0.48
CHRM1 P11229 4/20 0.48
CHRM2 P08172 1/20 0.48
CHRM3 P20309 1/20 0.48
KCNH2 Q12809 1/20 0.48
ALDH1A1 P00352 4/20 0.47
HIF1A Q16665 1/20 0.46
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
Hydrochloric Acid SCHEMBL1222196 0.88 DPP4 (0.80) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1222206 0.87 DPP4 (0.81) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1223118 0.86 DPP4 (0.77) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1223313 0.86 DPP4 (0.79) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1222591 0.85 DPP4 (0.69) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1223046 0.84 DPP4 (0.77) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1222930 0.84 DPP4 (0.98) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1222931 0.84 DPP4 (0.98) DPP4LMNACHRM1CHRM2CHRM3
Hydrochloric Acid SCHEMBL1223061 0.84 DPP4 (0.77) DPP4LMNACHRM1CHRM2CHRM3
Trifluoroacetic Acid SCHEMBL1223993 0.84 DPP4 (0.68) DPP4LMNACHRM1CHRM2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7888343-B2 Substituted, bicyclic 8-pyrrolidinoxanthines, and methods for their use as inhibitors of dipeptidyl peptidase Sanofi-A Ventis Deutschland GmbH (DE) 2011-02-15 US disclosed
US-20070197563-A1 SUBSTITUTED, BICYCLIC 8-PYRROLIDINOXANTHINES, AND METHODS FOR THEIR USE AS INHIBITORS OF DIPEPTIDYL PEPTIDASE SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-23 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 (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-20070197563-A1 SUBSTITUTED, BICYCLIC 8-PYRROLIDINOXANTHINES, AND METHODS FOR THEIR USE AS INHIBITORS OF DIPEPTIDYL PEPTIDASE DPP8, DPP7, DPP4 DPP4 3/4885LMNA 1392/4885CHRM1 4838/4885

“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.