SCHEMBL4333588

SCHEMBL4333588

COc1ncccc1NC(=O)c1nc(CN2CCS(O)(O)CC2)c2ccccn12

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.52
CNR2 P34972 5/20 0.52
CSF1R P07333 3/20 0.37
GPR6 P46095 9/20 0.36
HTR4 Q13639 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATR Q13535 1/20 0.35

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
SCHEMBL4333575 0.93 CNR1 (0.61) CNR1CNR2CSF1RGPR6HTR4
SCHEMBL4330523 0.84 CNR1 (0.52) CNR1CNR2L3MBTL1
SCHEMBL4334584 0.84 CNR2 (0.57) CNR1CNR2HTR4
SCHEMBL4331300 0.83 CNR1 (0.52) CNR1CNR2L3MBTL1
SCHEMBL4321804 0.83 CNR1 (0.55) CNR1CNR2
SCHEMBL4327706 0.83 CNR1 (0.62) CNR1CNR2
SCHEMBL4331238 0.81 CNR1 (0.50) CNR1CNR2
SCHEMBL4325964 0.80 CNR2 (0.52) CNR1CNR2CSF1RHTR4L3MBTL1
SCHEMBL4341823 0.79 CNR1 (0.54) CNR1CNR2
SCHEMBL4326279 0.79 CNR1 (0.50) CNR1CNR2GPR6

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-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 CNR1 2/4885CNR2 1/4885CSF1R 844/4885

“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.