SCHEMBL4338386

SCHEMBL4338386

CC(NC(=O)c1nc(-c2ccc(F)cc2)c2ccccn12)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.47
MAP2K3 P46734 1/20 0.45
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.44
RORC P51449 8/20 0.44
PPARG P37231 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR4 Q13639 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
SCHEMBL13578218 1.00 CNR2 (0.47) CNR2MAP2K3ALDH1A1KDM4EHPGD
SCHEMBL13578214 1.00 CNR2 (0.47) CNR2MAP2K3ALDH1A1KDM4EHPGD
Trifluoroacetic Acid SCHEMBL4333495 0.95 CNR2 (0.46) CNR2MAP2K3ALDH1A1KDM4EHPGD
Trifluoroacetic Acid SCHEMBL4324541 0.95 CNR2 (0.46) CNR2MAP2K3ALDH1A1KDM4EHPGD
SCHEMBL13578155 0.88 MAP2K3 (0.60) CNR2MAP2K3ALDH1A1KDM4ERORC
Trifluoroacetic Acid SCHEMBL4327394 0.85 MAP2K3 (0.54) CNR2MAP2K3ALDH1A1KDM4ERORC
SCHEMBL4322957 0.84 RORC (0.44) MAP2K3ALDH1A1KDM4EHPGDRORC
SCHEMBL4329405 0.83 MAPK1 (0.45) MAP2K3ALDH1A1KDM4EHPGDRORC
SCHEMBL13578112 0.82 CNR2 (0.48) CNR2MAP2K3ALDH1A1KDM4ERORC
SCHEMBL4331255 0.82 CNR2 (0.45) CNR2MAP2K3ALDH1A1KDM4ERORC

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 1/4885MAP2K3 1970/4885ALDH1A1 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.