SCHEMBL25201224

SCHEMBL25201224

CN(C#Cc1ccccn1)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.47
FFAR1 O14842 1/20 0.36
CYP1A2 P05177 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
PAX8 Q06710 1/20 0.34

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
SCHEMBL29659142 0.72 POLB (0.44) GPR119PAX8
SCHEMBL6601505 0.72 POLB (0.44) GPR119PAX8
SCHEMBL15390791 0.70 POLB (0.46) GRM5GPR119
SCHEMBL30676280 0.70 POLB (0.46) GRM5GPR119
Methyl Alcohol SCHEMBL28902013 0.69 GRM5 (0.67) GRM5FFAR1CYP1A2
SCHEMBL13382197 0.69 GRM5 (0.49) GRM5FFAR1CYP1A2
SCHEMBL4676290 0.69 HTR2C (0.49) CYP1A2
SCHEMBL13382203 0.68 GRM5 (0.45) GRM5FFAR1
SCHEMBL30898830 0.68 GRM5 (0.46) GRM5FFAR1PTGDR2
SCHEMBL18104914 0.68 FFAR1 (0.47) GRM5FFAR1CYP1A2

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-11667628-B2 Compounds for imaging tau proteins that accumulate in brain NATIONAL INSTITUTES FOR QUANTUM AND RADIOLOGICAL SCIENCE AND TECHNOLOGY (JP) 2023-06-06 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-11667628-B2 Compounds for imaging tau proteins that accumulate in brain MAPT, FABP7, HTT GRM5 2542/4885FFAR1 1755/4885CYP1A2 2557/4885

“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.