SCHEMBL1378672

SCHEMBL1378672

Nc1ncc(Oc2c(F)cccc2F)c(N[C@H]2CC[C@H](O)CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHUK O15111 1/20 0.39
MERTK Q12866 8/20 0.39
AXL P30530 4/20 0.39
MAPK8 P45983 3/20 0.39
MAPK14 Q16539 2/20 0.39
MAPK9 P45984 2/20 0.39
MAPK10 P53779 1/20 0.39
TYRO3 Q06418 4/20 0.38
FLT3 P36888 4/20 0.38
GAS6 Q14393 3/20 0.38
GCK P35557 1/20 0.38
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
BCL6 P41182 1/20 0.36
EGFR P00533 1/20 0.36
INSR P06213 1/20 0.36
LCK P06239 1/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
CSNK2A1 P68400 1/20 0.36

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
SCHEMBL1378675 1.00 CHUK (0.39) CHUKMERTKAXLMAPK8MAPK14
SCHEMBL7462219 0.91 MAPK14 (0.49) MAPK8MAPK14MAPK9MAPK10
SCHEMBL7462213 0.91 MAPK14 (0.49) MAPK8MAPK14MAPK9MAPK10
SCHEMBL1379044 0.90 MAPK14 (0.39) CHUKMERTKAXLMAPK8MAPK14
SCHEMBL1379042 0.90 MAPK14 (0.39) CHUKMERTKAXLMAPK8MAPK14
SCHEMBL5204412 0.85 LCK (0.46) CHUKMERTKAXLMAPK14TYRO3
SCHEMBL5204420 0.85 LCK (0.46) CHUKMERTKAXLMAPK14TYRO3
SCHEMBL1379441 0.84 MAPK14 (0.53) MAPK8MAPK14MAPK9MAPK10
SCHEMBL1379438 0.84 MAPK14 (0.53) MAPK8MAPK14MAPK9MAPK10
SCHEMBL5203505 0.82 MAPK14 (0.43) CHUKMERTKAXLMAPK8MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4743463-B2 2011-08-10 JP claimed
EP-1165523-B1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC (US) 2007-11-07 EP claimed
US-6583148-B1 Neurodegenerative or other neurological disorders; enhancing the effect of nerve growth factor; 2-Amino-5-(4-chlorophenoxy)-4-trans-4-hydroxycyclohexylamino) pyrimidine KRENITSKY PHARMACEUTICALS, INC. 2003-06-24 US claimed
JP-2002541245-A 2002-12-03 JP claimed
EP-1165523-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES Krenitsky Pharmaceuticals, Inc. (US) 2002-01-02 EP claimed
WO-2000061562-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC. (US) 2000-10-19 WO claimed
EP-1165523-B1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC (US) 2007-11-07 EP disclosed
US-6916820-B1 Neurotrophic substituted pyrimidines KRENITSKY PHARMACEUTICALS, INC. (US) 2005-07-12 US disclosed
US-6583148-B1 Neurodegenerative or other neurological disorders; enhancing the effect of nerve growth factor; 2-Amino-5-(4-chlorophenoxy)-4-trans-4-hydroxycyclohexylamino) pyrimidine KRENITSKY PHARMACEUTICALS, INC. 2003-06-24 US disclosed