SCHEMBL9102765

SCHEMBL9102765

CC(C)C(N)C(=O)N1CCC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.47
DPP7 Q9UHL4 11/20 0.47
DPP8 Q6V1X1 10/20 0.47
DPP9 Q86TI2 9/20 0.47
FAP Q12884 3/20 0.47
PREP P48147 2/20 0.47
PITRM1 Q5JRX3 1/20 0.47
SLC7A5 Q01650 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
SCHEMBL9102749 1.00 DPP4 (0.47) DPP4DPP7DPP8DPP9FAP
SCHEMBL111112 0.95 DPP4 (0.47) DPP4DPP7DPP8DPP9FAP
SCHEMBL296935 0.95 DPP4 (0.47) DPP4DPP7DPP8DPP9FAP
SCHEMBL1951493 0.95 DPP4 (0.47) DPP4DPP7DPP8DPP9FAP
Hydrochloric Acid SCHEMBL25318201 0.93 DPP4 (0.46) DPP4DPP7DPP8DPP9FAP
Hydrochloric Acid SCHEMBL9512271 0.93 DPP4 (0.46) DPP4DPP7DPP8DPP9FAP
Hydrochloric Acid SCHEMBL9512282 0.93 DPP4 (0.46) DPP4DPP7DPP8DPP9FAP
SCHEMBL2735523 0.93 DPP4 (0.46) DPP4DPP7DPP8DPP9FAP
SCHEMBL15203539 0.93 DPP4 (0.46) DPP4DPP7DPP8DPP9FAP
SCHEMBL19982029 0.93 DPP4 (0.46) DPP4DPP7DPP8DPP9FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2013-06-06 US disclosed
US-8361998-B2 Compounds and their use as IKACh blockers ASTRAZENECA AB 2013-01-29 US disclosed
WO-2012074469-A1 NEW IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 WO disclosed
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 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 (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-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 DPP4 4071/4885DPP7 2847/4885DPP8 3018/4885
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 DPP4 4071/4885DPP7 2847/4885DPP8 3018/4885

“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.