SCHEMBL4327094

SCHEMBL4327094

O=C(NCC1(CO)CCCCC1)c1nc(C2CC2)n2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 8/20 0.63
▸ CNR1 P21554 1/20 0.61
▸ HTR4 Q13639 10/20 0.42
▸ SMO Q99835 1/20 0.39

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
SCHEMBL4326105 0.99 CNR2 (0.64) CNR2CNR1HTR4SMO
SCHEMBL4332664 0.97 CNR2 (0.62) CNR2CNR1HTR4
SCHEMBL13578103 0.80 CNR2 (0.61) CNR2CNR1HTR4
SCHEMBL4320093 0.79 CNR2 (0.61) CNR2CNR1HTR4
SCHEMBL13578104 0.79 CNR2 (0.62) CNR2CNR1HTR4
SCHEMBL13578256 0.79 CNR2 (0.72) CNR2CNR1HTR4SMO
SCHEMBL13578361 0.79 CNR2 (0.98) CNR2CNR1HTR4
SCHEMBL4332142 0.78 CNR2 (0.66) CNR2CNR1HTR4
SCHEMBL13578255 0.78 CNR2 (0.73) CNR2CNR1HTR4SMO
SCHEMBL13578360 0.77 CNR2 (1.00) CNR2CNR1HTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 — — US disclosed
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 — — 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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES CNR2, CNR1, TRPV1 CNR2 1/4885CNR1 2/4885HTR4 254/4885

“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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