SCHEMBL4329757

SCHEMBL4329757

CC(C)(CO)CNC(=O)c1nc(-c2cccc(Cl)c2)n2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.47
HTR4 Q13639 1/20 0.43
CNR1 P21554 2/20 0.39
MDM2 Q00987 3/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
MAPT P10636 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
MAP3K14 Q99558 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 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
SCHEMBL4333497 0.91 CNR2 (0.57) CNR2CNR1MDM2NPC1RAB9A
SCHEMBL13578105 0.84 CNR2 (0.50) CNR2HTR4MAPTKDM4EALDH1A1
SCHEMBL4331152 0.82 PTGER4 (0.50) CNR2NPC1RAB9AL3MBTL1CASP3
SCHEMBL4320324 0.82 CNR2 (0.51) CNR2CNR1NPC1L3MBTL1CASP3
SCHEMBL4326415 0.81 KDM4E (0.49) CNR2CNR1NPC1RAB9AL3MBTL1
Trifluoroacetic Acid SCHEMBL4338464 0.80 CNR2 (0.47) CNR2HTR4L3MBTL1MAPTKDM4E
SCHEMBL4325237 0.80 CNR2 (0.54) CNR2CNR1MDM2NPC1RAB9A
SCHEMBL4329324 0.80 MAPT (0.46) CNR2CNR1MAPTALDH1A1GAA
SCHEMBL4325290 0.79 PTGFR (0.42) CNR2MDM2L3MBTL1MAPTCASP3
SCHEMBL4332820 0.78 CNR2 (0.45) CNR2CNR1MDM2MAPTGAA

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 1/4885HTR4 254/4885CNR1 2/4885

“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.