SCHEMBL9891993

SCHEMBL9891993

CCCc1cc(NC(=O)[C@@H]2C[C@@H](O)CN2CC2CCOCC2)on1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.73
CNR1 P21554 12/20 0.45
PRKCB P05771 1/20 0.36
RPS6KA2 Q15349 1/20 0.35
ENPP2 Q13822 2/20 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
SCHEMBL9891994 0.88 CNR2 (0.78) CNR2CNR1
SCHEMBL9892135 0.85 CNR2 (1.00) CNR2CNR1
SCHEMBL9892042 0.85 CNR2 (1.00) CNR2CNR1
SCHEMBL9892060 0.83 CNR2 (0.82) CNR2CNR1
SCHEMBL2576705 0.78 CNR2 (0.74) CNR2CNR1
SCHEMBL9891986 0.74 CNR2 (0.57) CNR2CNR1
SCHEMBL9892117 0.72 CNR2 (0.68) CNR2CNR1
SCHEMBL9892000 0.72 CNR2 (0.69) CNR2CNR1
SCHEMBL9891985 0.72 CNR2 (0.69) CNR2CNR1
SCHEMBL9891999 0.71 CNR2 (0.62) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 US disclosed
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 CNR2 1/4885CNR1 2/4885PRKCB 707/4885

“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.