SCHEMBL4492198

SCHEMBL4492198

CC(N)C1(CO)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.35
SLC6A3 Q01959 8/20 0.33
SLC6A4 P31645 7/20 0.33
SLC6A2 P23975 5/20 0.33

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
SCHEMBL25663480 1.00 DPP4 (0.35) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL4497021 0.98 DPP4 (0.33) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL25663459 0.98 DPP4 (0.33) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL25663431 0.93
SCHEMBL4489953 0.93
SCHEMBL25663394 0.87
SCHEMBL29067365 0.87
SCHEMBL873936 0.80 DPP4 (0.30) DPP4
SCHEMBL14899026 0.80 DPP4 (0.30) DPP4
SCHEMBL914671 0.78 TDP1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275619-A1 Amide Substituted Indazole and Benzotriazole Derivatives as Poly(ADP-Ribose)Polymerase (PARP) Inhibitors ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-11-05 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-20090275619-A1 Amide Substituted Indazole and Benzotriazole Derivatives as Poly(ADP-Ribose)Polymerase (PARP) Inhibitors PARP1, PARP3, PARP2 DPP4 861/4885SLC6A3 3265/4885SLC6A4 3914/4885

“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.