SCHEMBL9892789

SCHEMBL9892789

CCc1nc(NC(=O)[C@@H]2CCN2CC2CCOCC2)nn1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.44
CNR1 P21554 5/20 0.44
JAK1 P23458 6/20 0.38
JAK2 O60674 4/20 0.38
LMNA P02545 2/20 0.36
JAK3 P52333 2/20 0.36
TYK2 P29597 1/20 0.36
HSD11B1 P28845 1/20 0.36
C5AR1 P21730 1/20 0.36
NR1H2 P55055 1/20 0.35
MAPT P10636 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
SCHEMBL13284561 0.94 CNR2 (0.52) CNR2CNR1JAK1JAK2LMNA
SCHEMBL16254983 0.94 CNR2 (0.52) CNR2CNR1JAK1JAK2LMNA
SCHEMBL9892061 0.87 CNR2 (0.51) CNR2CNR1JAK1JAK2LMNA
SCHEMBL9892784 0.85 CNR2 (0.41) CNR2CNR1JAK1JAK2LMNA
SCHEMBL2123122 0.75 ALDH1A1 (0.60) CNR2CNR1LMNAMAPT
SCHEMBL20458159 0.75 ALDH1A1 (0.60) CNR2CNR1LMNAMAPT
SCHEMBL3790780 0.75 CNR2 (0.51) CNR2CNR1JAK1JAK2LMNA
SCHEMBL13256989 0.75 CNR2 (0.51) CNR2CNR1JAK1JAK2LMNA
SCHEMBL9892924 0.74 MEN1 (0.48) LMNAMAPT
SCHEMBL9892870 0.73 KHK (0.46) JAK1JAK2LMNA

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-8383615-B2 Azetidine 2-carboxamide derivatives which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-02-26 US disclosed
US-20120142666-A1 Azetidine 2-Carboxamide Derivatives 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-20120142666-A1 Azetidine 2-Carboxamide Derivatives Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 CNR2 1/4885CNR1 2/4885JAK1 3368/4885

“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.