SCHEMBL4461480

SCHEMBL4461480

O=C(c1ccccc1)c1nc(CN2CCOCC2)c2ccccn12

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.69
CNR2 P34972 5/20 0.69
ALDH1A1 P00352 5/20 0.43
MAPK1 P28482 1/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 2/20 0.43
RORC P51449 1/20 0.42
HIF1A Q16665 3/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
EPAS1 Q99814 1/20 0.40
ABCB1 P08183 2/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL3058529 0.91 CNR1 (0.66) CNR1CNR2ALDH1A1MAPK1MAPT
SCHEMBL4326889 0.91 CNR1 (0.70) CNR1CNR2ALDH1A1MAPK1MAPT
SCHEMBL2743123 0.90 CNR1 (0.68) CNR1CNR2ALDH1A1MAPTKMT2A
SCHEMBL4341215 0.89 CNR1 (0.62) CNR1CNR2ALDH1A1MAPK1RORC
SCHEMBL4455261 0.89 CNR1 (0.62) CNR1CNR2ALDH1A1MAPK1MAPT
SCHEMBL13578113 0.88 CNR2 (0.65) CNR1CNR2ALDH1A1RORCHTT
SCHEMBL4326567 0.88 CNR2 (0.68) CNR1CNR2ALDH1A1MAPTHIF1A
SCHEMBL4331773 0.88 CNR1 (0.63) CNR1CNR2KMT2ARORCRAB9A
SCHEMBL4326760 0.86 CNR2 (0.67) CNR1CNR2ALDH1A1MAPTKDM4E
SCHEMBL18039524 0.86 CNR1 (0.66) CNR1CNR2ALDH1A1HIF1AHPGD

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 3 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
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 1/4885ALDH1A1 2838/4885

“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.