SCHEMBL4334731

SCHEMBL4334731

Cc1cccc(NC(=O)c2nc(CN3CCS(=O)(=O)CC3)c3ccccn23)n1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.76
CNR2 P34972 5/20 0.76
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
TP53 P04637 2/20 0.47
GRM5 P41594 2/20 0.40
HPGD P15428 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
JAK1 P23458 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL4334740 0.93 CNR1 (0.65) CNR1CNR2NPC1RAB9ATP53
SCHEMBL4325260 0.89 CNR1 (0.66) CNR1CNR2MAPT
SCHEMBL4320080 0.89 CNR2 (0.76) CNR1CNR2NPC1RAB9ATP53
SCHEMBL4328542 0.87 CNR2 (0.77) CNR1CNR2NPC1RAB9ATP53
SCHEMBL4327707 0.87 CNR1 (0.73) CNR1CNR2NPC1RAB9AJAK1
SCHEMBL4339536 0.86 CNR2 (1.00) CNR1CNR2GRM5JAK1
SCHEMBL4324702 0.86 CNR2 (0.64) CNR1CNR2NPC1RAB9AALDH1A1
SCHEMBL13578117 0.85 CNR1 (0.61) CNR1CNR2NPC1RAB9AALDH1A1
SCHEMBL4333044 0.85 CNR1 (0.66) CNR1CNR2NPC1RAB9ATP53
SCHEMBL4328048 0.85 CNR1 (0.70) CNR1CNR2NPC1RAB9A

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 CNR1 2/4885CNR2 1/4885NPC1 1236/4885

“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.