SCHEMBL2470836

SCHEMBL2470836

CC(=O)c1ccc(-n2cc(-c3c(-c4ccccc4)noc3C)nc2C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.48
PTGS2 P35354 6/20 0.46
PTGS1 P23219 4/20 0.46
BRD4 O60885 2/20 0.44
MAPK8 P45983 1/20 0.42
HTT P42858 1/20 0.42
BRD2 P25440 1/20 0.41
CREBBP Q92793 1/20 0.41
MT-CO2 P00403 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
LMNA P02545 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
SCHEMBL2470784 0.83 MAPK14 (0.42) MAPK14PTGS2PTGS1BRD4MAPK8
SCHEMBL2472887 0.82 PTGS1 (0.48) MAPK14PTGS2PTGS1HTTMT-CO2
SCHEMBL2471999 0.82 PTGS2 (0.45) MAPK14PTGS2PTGS1HTTMT-CO2
SCHEMBL2471395 0.80 MAPK14 (0.48) MAPK14PTGS2PTGS1BRD4MAPK8
SCHEMBL2471679 0.80 PTGS2 (0.50) MAPK14PTGS2PTGS1MAPK8HTT
SCHEMBL5423328 0.78 PTGS2 (0.71) MAPK14PTGS2PTGS1BRD4BRD2
SCHEMBL2472255 0.77 PTGS2 (0.52) MAPK14PTGS2PTGS1BRD4MAPK8
SCHEMBL2470928 0.76 MAPK14 (0.48) MAPK14PTGS2PTGS1MAPK8MT-CO2
SCHEMBL2474850 0.76 NPC1 (0.46) MAPK14PTGS2PTGS1MAPK8HTT
SCHEMBL2472497 0.74 MAPK14 (0.49) MAPK14PTGS2PTGS1MAPK8HTT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1968973-B1 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-10-05 EP claimed
EP-1968973-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2008-09-17 EP claimed
US-7414061-B2 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-08-19 US claimed
US-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. 2007-07-12 US claimed
WO-2007074078-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-07-05 WO claimed
EP-1968973-B1 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-10-05 EP disclosed
EP-1968973-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2008-09-17 EP disclosed
US-7414061-B2 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-08-19 US disclosed
US-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. 2007-07-12 US disclosed
WO-2007074078-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-07-05 WO 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-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives GABRA5, GABRA4, GABRA1 MAPK14 4327/4885PTGS2 3762/4885PTGS1 2693/4885

“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.