SCHEMBL13045735

SCHEMBL13045735

COPCn1nnc2c(O)cccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 15/20 0.41
▸ KCNMA1 Q12791 1/20 0.36
▸ MGAM O43451 1/20 0.33
▸ AMY1A P0DUB6 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ SI P14410 1/20 0.33
▸ MGAM2 Q2M2H8 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ TLR8 Q9NR97 1/20 0.33

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
SCHEMBL1957956 0.73 GRM2 (0.50) GRM2
SCHEMBL1956444 0.70 GRM2 (0.38) GRM2KCNMA1MGAMAMY1AGAA
SCHEMBL10734042 0.69 SLC9A1 (0.48) GRM2KCNMA1GAATLR8
SCHEMBL378660 0.67 POLB (0.50) GRM2KCNMA1GAATLR8
Water SCHEMBL3673310 0.65 POLB (0.48) GRM2KCNMA1GAATLR8
SCHEMBL3767410 0.65 ACHE (0.39) GRM2KCNMA1MGAMAMY1AGAA
SCHEMBL8146888 0.65 MAPT (0.48) KCNMA1GAATLR8
SCHEMBL8425686 0.65 ACHE (0.39) GRM2KCNMA1GAATLR8
SCHEMBL8907627 0.63 KCNMA1 (0.45) KCNMA1MGAMAMY1AGAASI
SCHEMBL4233106 0.63 GRM2 (0.49) GRM2

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-20100286192-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS ANTHONY NEVILLE J 2010-11-11 — — 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-20100286192-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS RNGTT, RRM2B, RRM2 GRM2 4302/4885KCNMA1 3180/4885MGAM 1160/4885

“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.

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