SCHEMBL6587012

SCHEMBL6587012

Fc1ccc(-c2c(-c3ccncc3)nc(I)n2CCCc2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.66
MAPK13 O15264 10/20 0.51
MAPK12 P53778 10/20 0.51
MAPK11 Q15759 10/20 0.51
GCGR P47871 2/20 0.51
MAPK10 P53779 1/20 0.49
ALOX5 P09917 2/20 0.42

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
SCHEMBL1127766 1.00 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL6581107 0.86 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5858720 0.86 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7139249 0.86 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL13670475 0.84 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5903491 0.82 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5998654 0.82 MAPK14 (0.87) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL27489999 0.81 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7162537 0.81 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5820266 0.81 MAPK14 (0.85) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392678-A2 PROCESS FOR THE PREPARATION OF TETRASUBSTITUTED IMIDAZOLE DERIVATIVES AND NOVEL CRYSTALLINE STRUCTURES THEREOF Ortho-Mcneil Pharmaceutical, Inc. (US) 2004-03-03 EP disclosed
WO-2002076974-A2 PROCESS FOR THE PREPARATION OF TETRASUBSTITUTED IMIDAZOLE DERIVATIVES AND NOVEL CRYSTALLINE STRUCTURES THEREOF ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2002-10-03 WO disclosed