SCHEMBL26537222

SCHEMBL26537222

CCCCNC(C)(C)/C(C)=N/O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.34
TSHR P16473 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL8693325 0.89 POLB (0.37) POLBTSHR
SCHEMBL8693335 0.89 POLB (0.37) POLBTSHR
Upenazime SCHEMBL1477985 0.89 POLB (0.37) POLBTSHR
SCHEMBL15144439 0.87 POLB (0.36) POLBTSHR
SCHEMBL15135657 0.87 POLB (0.36) POLBTSHR
SCHEMBL8362134 0.82 POLB (0.33) POLBTSHR
SCHEMBL8362130 0.82 POLB (0.33) POLBTSHR
SCHEMBL7118056 0.82 POLB (0.33) POLB
SCHEMBL7118054 0.82 POLB (0.33) POLB
SCHEMBL8476513 0.80 PAOX (0.38) POLBTSHR

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-20230321287-A1 RADIOLABELLED GRPR-ANTAGONIST FOR USE AS THERAGNOSTIC NOVARTIS AG (CH) 2023-10-12 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-20230321287-A1 RADIOLABELLED GRPR-ANTAGONIST FOR USE AS THERAGNOSTIC GRPR, GIPR, SCTR POLB 4701/4885TSHR 93/4885GRIN2D 1178/4885

“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.