SCHEMBL10134276

SCHEMBL10134276

CCC(C)(C)Oc1ncnc(Nc2ccc(C#N)cc2Cl)c1OC

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.50
LRRK2 Q5S007 1/20 0.38
SRC P12931 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
SCHEMBL10105792 0.90 GPR119 (0.53) GPR119LRRK2SRC
SCHEMBL10120673 0.88 GPR119 (0.50) GPR119
SCHEMBL10120558 0.86 GPR119 (0.51) GPR119LRRK2SRC
SCHEMBL10120568 0.86 GPR119 (0.54) GPR119LRRK2SRC
SCHEMBL10120490 0.82 GPR119 (0.47) GPR119LRRK2SRC
SCHEMBL10134273 0.81 AR (0.42) GPR119
SCHEMBL10120508 0.81 GPR119 (0.51) GPR119LRRK2SRC
SCHEMBL10134274 0.79 GPR119 (0.53) GPR119
SCHEMBL10120672 0.79 GPR119 (0.47) GPR119
SCHEMBL12319936 0.77 GPR119 (0.58) GPR119LRRK2SRC

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-20120021976-A1 BICYCLIC PIPERIDINE AND PIPERAZINE DERIVATIVES AS GPCR MODULATORS FOR THE TREATMENT OF OBESITY, DIABETES AND OTHER METABOLIC DISORDERS MERCK SHARP & DOHME LLC 2012-01-26 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-20120021976-A1 BICYCLIC PIPERIDINE AND PIPERAZINE DERIVATIVES AS GPCR MODULATORS FOR THE TREATMENT OF OBESITY, DIABETES AND OTHER METABOLIC DISORDERS GPR119, GPR55, GPR4 GPR119 1/4885LRRK2 463/4885SRC 2958/4885

“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.