SCHEMBL122282

SCHEMBL122282

CCc1noc(N2CCC([C@H](C)CCOc3cnc(N4C[C@H](c5cc(F)c(F)cc5F)[C@@H](N)C4)nc3)CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.39
DPP7 Q9UHL4 12/20 0.38
DPP8 Q6V1X1 11/20 0.38
DPP9 Q86TI2 9/20 0.38
MCHR1 Q99705 2/20 0.38
KCNH2 Q12809 2/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL122265 0.91 GPR119 (0.41) DPP4DPP7DPP8DPP9MCHR1
SCHEMBL151875 0.91 DPP4 (0.36) DPP4DPP7DPP8DPP9MCHR1
SCHEMBL120042 0.90 ALDH1A1 (0.33) DPP4DPP7DPP8DPP9MCHR1
SCHEMBL145107 0.84 DPP4 (0.32) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL145106 0.84 DPP4 (0.32) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL119963 0.83 GPR119 (0.41) DPP4DPP8DPP9MCHR1KCNH2
SCHEMBL122308 0.83 GPR119 (0.41) DPP4MCHR1KCNH2
SCHEMBL470666 0.83 DPP4 (0.40) DPP4DPP7DPP8DPP9MCHR1
SCHEMBL152098 0.83 GPR119 (0.44) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL152371 0.83 GPR119 (0.35) DPP4DPP7DPP8DPP9MCHR1

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-20120059014-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-08 US disclosed
US-20120059014-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-08 US disclosed
WO-2010103334-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 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-20120059014-A1 Compounds for the Treatment of Metabolic Disorders GPR119, FFAR2, GPBAR1 DPP4 407/4885DPP7 482/4885DPP8 1048/4885

“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.