SCHEMBL947643

SCHEMBL947643

CCc1nccn1CC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.48
GPR119 Q8TDV5 12/20 0.48
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 0.45
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
FPR2 P25090 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL949087 0.90 GPR119 (0.50) FAAHGPR119KDM4EPKMOPRD1
SCHEMBL948688 0.89 FAAH (0.54) FAAHGPR119KDM4EPKM
SCHEMBL948973 0.86 GPR119 (0.50) FAAHGPR119KDM4EPKMOPRD1
SCHEMBL947133 0.81 GPR119 (0.50) FAAHGPR119KDM4E
SCHEMBL29079722 0.81 FAAH (0.46) FAAHGPR119KDM4EPKMOPRD1
SCHEMBL6151661 0.80 KDM4E (0.52) FAAHGPR119KDM4EPKMOPRD1
SCHEMBL948342 0.78 GPR119 (0.52) FAAHGPR119KDM4EPKM
SCHEMBL947729 0.77 FAAH (0.56) FAAHGPR119KDM4EPKM
SCHEMBL21058654 0.77 FAAH (0.48) FAAHGPR119KDM4EPKM
SCHEMBL190831 0.76 GPR119 (0.49) FAAHGPR119KDM4EPKMBACE1

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-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20070004736-A1 Imidazole derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-04 US disclosed
EP-1564213-A1 IMIDAZOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-08-17 EP 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-20070004736-A1 Imidazole derivative, process for producing the same, and use HRH4, F2, HRH2 FAAH 1246/4885GPR119 1327/4885KDM4E 1356/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 FAAH 1524/4885GPR119 1118/4885KDM4E 1558/4885

“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.