SCHEMBL4965769

SCHEMBL4965769

COc1cc2ncnc(N(OC(=O)C(F)(F)F)C3CCNCC3)c2cc1OC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK7 Q13164 4/20 0.44
EGFR P00533 8/20 0.43
CSF1R P07333 5/20 0.43
KDR P35968 4/20 0.41
RET P07949 1/20 0.41
KIF5B P33176 1/20 0.41
PDE10A Q9Y233 2/20 0.40
EHMT2 Q96KQ7 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
JAK3 P52333 1/20 0.40
FGFR1 P11362 3/20 0.39
FLT1 P17948 3/20 0.39
FLT4 P35916 3/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
ENPP1 P22413 1/20 0.38

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
SCHEMBL4969267 0.94 MAPK7 (0.42) MAPK7EGFRCSF1RKDRRET
Trifluoroacetic Acid SCHEMBL4965758 0.71 IRAK4 (0.57) EGFRKDREHMT2FGFR1FLT1
Trifluoroacetic Acid SCHEMBL30264700 0.71 KIT (0.46) MAPK7EGFRKDRPDE10AFGFR1
SCHEMBL4965766 0.71 PDE10A (0.55) PDE10AJAK2JAK1JAK3ENPP1
Trifluoroacetic Acid SCHEMBL30264814 0.68 PDE10A (0.64) MAPK7EGFRPDE10A
Trifluoroacetic Acid SCHEMBL4969262 0.68 IRAK4 (0.53) EGFRKDREHMT2FGFR1FLT1
SCHEMBL3563598 0.67 MAPK7 (0.54) MAPK7EGFRKDRFGFR1FLT1
Trifluoroacetic Acid SCHEMBL4969504 0.67 PDE10A (0.39) MAPK7EGFRKDRPDE10AEHMT2
SCHEMBL5037882 0.67 MEN1 (0.40)
SCHEMBL27438304 0.67 EGFR (0.58) EGFRCSF1RKDRRETKIF5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899319-A2 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-19 EP disclosed
EP-1893206-A2 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-05 EP disclosed
WO-2006135649-A2 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-21 WO disclosed
WO-2006135636-A2 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-21 WO disclosed