SCHEMBL1775405

SCHEMBL1775405

CC(C)(C)OC(=O)N1CCC(c2nc(C#Cc3cccnc3)cs2)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.50
GRM5 P41594 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
FAAH O00519 1/20 0.44
CCNA2 P20248 1/20 0.44
CDK2 P24941 1/20 0.44
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
GBA1 P04062 1/20 0.40

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
SCHEMBL27847328 0.86 GRM5 (0.48) GRM5CYP1A2CYP2D6FAAH
SCHEMBL1774940 0.85 GRM5 (0.50) GRM5CYP1A2CYP2D6FAAH
SCHEMBL1775285 0.80 GPR119 (0.47) GPR119GRM5FAAH
SCHEMBL1775738 0.80 GPR119 (0.44) GPR119GRM5FAAHGBA1
SCHEMBL1774898 0.79 GAA (0.48) GPR119FAAHKEAP1NFE2L2
SCHEMBL1775429 0.79 GPR119 (0.49) GPR119
SCHEMBL2070468 0.77 GPR119 (0.48) GPR119
Tert-Butyl Formate SCHEMBL27828688 0.77 GRM5 (0.47) GRM5CYP1A2CYP2D6
SCHEMBL1433831 0.75 GPR119 (0.43) GPR119FAAH
SCHEMBL1773621 0.75 CYP1A2 (0.45) GRM5CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334669-B1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS BAYER IP GMBH (DE) 2015-12-23 EP disclosed
EP-2334669-A1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS Bayer CropScience AG (DE) 2011-06-22 EP disclosed
US-7943774-B2 Heterocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2011-05-17 US disclosed
US-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
WO-2010037479-A1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS BAYER CROPSCIENCE AG (DE) 2010-04-08 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-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents CYP8B1, CYP51A1, HPD GPR119 3388/4885GRM5 3932/4885CYP1A2 51/4885

“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.