SCHEMBL4412830

SCHEMBL4412830

Cc1ccc(NC(=O)c2cc(N3CCCCC3)cc(C(F)(F)F)c2)cc1-c1cc(C(=O)NCc2cccnc2)on1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 14/20 0.52
BRAF P15056 14/20 0.52
TEK Q02763 1/20 0.51
CSF1R P07333 4/20 0.48
LYN P07948 1/20 0.47
DDR1 Q08345 1/20 0.45
DDR2 Q16832 1/20 0.45
MAPK14 Q16539 1/20 0.44

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
SCHEMBL4419873 0.99 RAF1 (0.52) RAF1BRAFTEKCSF1RLYN
SCHEMBL4413471 0.94 RAF1 (0.58) RAF1BRAFTEKCSF1RMAPK14
SCHEMBL4411272 0.91 MAPK14 (0.46) RAF1BRAFTEKMAPK14
SCHEMBL4410223 0.90 MAPK14 (0.47) RAF1BRAFTEKMAPK14
SCHEMBL4416214 0.88 MAPK14 (0.43) RAF1BRAFTEKMAPK14
SCHEMBL4408184 0.87 MAPK14 (0.56) RAF1BRAFCSF1RLYNMAPK14
SCHEMBL4418552 0.87 MAPK14 (0.44) RAF1BRAFTEKMAPK14
SCHEMBL4412866 0.86 RAF1 (0.56) RAF1BRAFCSF1RLYN
SCHEMBL4551494 0.86 MAPK14 (0.51) RAF1BRAFMAPK14
SCHEMBL4417023 0.86 RAF1 (0.56) RAF1BRAFCSF1RLYN

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