SCHEMBL4114263

SCHEMBL4114263

CC(C)(C)C(N)C(=O)N1COCC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 7/20 0.36
DPP8 Q6V1X1 5/20 0.35
DPP9 Q86TI2 5/20 0.35
DPP7 Q9UHL4 2/20 0.35
FAP Q12884 1/20 0.35
CNR2 P34972 3/20 0.31

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
SCHEMBL4114260 0.80 CNR2 (0.31) CNR2
SCHEMBL13472118 0.73 CNR2 (0.33) CNR2
SCHEMBL14547243 0.70 CNR2 (0.35) CNR2
SCHEMBL16727329 0.69 CNR2 (0.34) CNR2
SCHEMBL425266 0.69 CNR2 (0.37) DPP4DPP8DPP9CNR2
SCHEMBL13612712 0.66 ALDH1A1 (0.38) CNR2
SCHEMBL2834119 0.66 CNR2 (0.34) DPP4DPP8DPP9CNR2
SCHEMBL16885247 0.66 CNR2 (0.39) CNR2
SCHEMBL342908 0.65 DPP4 (0.49) DPP4DPP8DPP9DPP7FAP
SCHEMBL342909 0.65 DPP4 (0.49) DPP4DPP8DPP9DPP7FAP

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-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US claimed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 US claimed

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-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CNR1, CNR2, TRPV1 DPP4 4359/4885DPP8 3805/4885DPP9 4313/4885

“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.