SCHEMBL5199146

SCHEMBL5199146

CCn1c(C(O)(CC)CC)nc(-c2ccncc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.40
MAPK13 O15264 4/20 0.40
MAPK12 P53778 4/20 0.40
MAPK11 Q15759 4/20 0.40
GCGR P47871 4/20 0.36
CNR1 P21554 5/20 0.36
TEK Q02763 1/20 0.36
LSS P48449 1/20 0.35
OPRL1 P41146 1/20 0.34
CYP19A1 P11511 1/20 0.34
RAF1 P04049 1/20 0.34

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
SCHEMBL5194594 0.88 MAPK14 (0.36) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5184567 0.87 NPSR1 (0.39) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5199032 0.86 GCGR (0.43) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5197480 0.86 MAPK14 (0.38) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5199808 0.84 OPRL1 (0.38) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5184636 0.83 CNR1 (0.42) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5199024 0.82 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5199376 0.79 CYP19A1 (0.45) MAPK14MAPK13MAPK12MAPK11CYP19A1
SCHEMBL5184902 0.79 CYP19A1 (0.43) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5197184 0.78 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11GCGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1846389-A1 IMIDAZOLE DERIVATIVES F. Hoffmann-Roche AG (CH) 2007-10-24 EP claimed
WO-2006082002-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-08-10 WO claimed
US-20060173048-A1 Imidazole derivatives F. HOFFMAN-LA ROCHE AG (CH) 2006-08-03 US claimed
EP-1846389-A1 IMIDAZOLE DERIVATIVES F. Hoffmann-Roche AG (CH) 2007-10-24 EP disclosed
WO-2006082002-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-08-10 WO disclosed
US-20060173048-A1 Imidazole derivatives F. HOFFMAN-LA ROCHE AG (CH) 2006-08-03 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-20060173048-A1 Imidazole derivatives GRM2, GRM1, GRIN2C MAPK14 2620/4885MAPK13 2722/4885MAPK12 2936/4885

“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.