SCHEMBL8188151

SCHEMBL8188151

NCC1(c2cccc(Cl)c2)CCC(NS(=O)(=O)Cc2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 11/20 0.52
SLC6A4 P31645 4/20 0.50
SLC6A3 Q01959 4/20 0.50
DPP8 Q6V1X1 6/20 0.49
DPP9 Q86TI2 5/20 0.49
KCNH2 Q12809 1/20 0.41
CYP2D6 P10635 1/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38

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 SCHEMBL14483511 0.99 DPP4 (0.51) DPP4SLC6A4SLC6A3DPP8DPP9
Hydrochloric Acid SCHEMBL14483510 0.99 DPP4 (0.51) DPP4SLC6A4SLC6A3DPP8DPP9
Hydrochloric Acid SCHEMBL14483508 0.99 DPP4 (0.51) DPP4SLC6A4SLC6A3DPP8DPP9
SCHEMBL14549853 0.84 DPP4 (0.54) DPP4SLC6A4SLC6A3DPP8DPP9
SCHEMBL8188146 0.84 DPP4 (0.54) DPP4SLC6A4SLC6A3DPP8DPP9
SCHEMBL14549848 0.84 DPP4 (0.54) DPP4SLC6A4SLC6A3DPP8DPP9
Hydrochloric Acid SCHEMBL14483002 0.83 DPP4 (0.53) DPP4SLC6A4SLC6A3DPP8DPP9
Hydrochloric Acid SCHEMBL14483006 0.83 DPP4 (0.53) DPP4SLC6A4SLC6A3DPP8DPP9
Hydrochloric Acid SCHEMBL14483003 0.83 DPP4 (0.53) DPP4SLC6A4SLC6A3DPP8DPP9
SCHEMBL14549842 0.83 DPP4 (0.60) DPP4SLC6A4SLC6A3DPP8DPP9

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-20130012485-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-01-10 US disclosed
US-20130012485-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-01-10 US disclosed
WO-2008077597-A1 1-AMINOMETHYL- L- PHENYL- CYCLOHEXANE DERIVATIVES AS DDP-IV INHIBITORS NOVARTIS AG (CH) 2008-07-03 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-20130012485-A1 ORGANIC COMPOUNDS DPP4, DPP3, DPP7 DPP4 1/4885SLC6A4 461/4885SLC6A3 399/4885

“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.