SCHEMBL4420764

SCHEMBL4420764

Cc1ccc(NC(=O)c2ccnc(N3CCOCC3)c2)cc1-c1cc(C(=O)NCC(C)(C)C)on1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRAF P15056 19/20 0.61
RAF1 P04049 18/20 0.61
MAPK13 O15264 1/20 0.59
HSPB1 P04792 1/20 0.59
MAPK12 P53778 1/20 0.59
MAPK11 Q15759 1/20 0.59
MAPK14 Q16539 1/20 0.59

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
SCHEMBL4413422 0.94 MAPK14 (0.59) BRAFRAF1MAPK13HSPB1MAPK12
SCHEMBL4417882 0.94 MAPK14 (0.59) BRAFRAF1MAPK13HSPB1MAPK12
SCHEMBL4408526 0.86 RAF1 (0.57) BRAFRAF1MAPK14
SCHEMBL4551383 0.84 BRAF (0.54) BRAFRAF1
SCHEMBL4565118 0.83 RAF1 (0.56) BRAFRAF1MAPK14
SCHEMBL4552241 0.82 RAF1 (0.63) BRAFRAF1
SCHEMBL4412693 0.82 RAF1 (0.49) BRAFRAF1
SCHEMBL4551893 0.81 RAF1 (0.54) BRAFRAF1MAPK14
SCHEMBL5604341 0.81 MAPK14 (0.43) BRAFRAF1HSPB1MAPK14
SCHEMBL4565686 0.81 RAF1 (0.51) BRAFRAF1

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
EP-2035005-A2 THERAPY USING CYTOKINE INHIBITORS Kemia, INC. (US) 2009-03-18 EP disclosed
WO-2007146712-A2 THERAPY USING CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-12-21 WO disclosed
WO-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed