SCHEMBL1378749

SCHEMBL1378749

CC(C)c1ccc(Oc2cnc(N)nc2N[C@H]2CC[C@H](O)CC2)cc1.CCCCc1ccc(Oc2cnc(N)nc2N[C@H]2CC[C@H](O)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYRO3 Q06418 19/20 0.43
MERTK Q12866 19/20 0.43
GAS6 Q14393 19/20 0.43
FLT3 P36888 17/20 0.43
AXL P30530 3/20 0.37

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
SCHEMBL1378746 1.00 TYRO3 (0.43) TYRO3MERTKGAS6FLT3AXL
SCHEMBL5209213 0.94 TYRO3 (0.47) TYRO3MERTKGAS6FLT3AXL
SCHEMBL5209220 0.94 TYRO3 (0.47) TYRO3MERTKGAS6FLT3AXL
SCHEMBL5207324 0.90 HSP90AA1 (0.40) TYRO3MERTKGAS6FLT3AXL
SCHEMBL5207331 0.90 HSP90AA1 (0.40) TYRO3MERTKGAS6FLT3AXL
SCHEMBL7157262 0.84 MERTK (0.42) TYRO3MERTKGAS6FLT3AXL
SCHEMBL7157258 0.84 MERTK (0.42) TYRO3MERTKGAS6FLT3AXL
Hydrochloric Acid SCHEMBL5203349 0.83 MERTK (0.41) TYRO3MERTKGAS6FLT3AXL
Hydrochloric Acid SCHEMBL5203355 0.83 MERTK (0.41) TYRO3MERTKGAS6FLT3AXL
SCHEMBL5203150 0.79 BTK (0.40) TYRO3MERTKGAS6FLT3AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4743463-B2 2011-08-10 JP 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-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES Krenitsky Pharmaceuticals, Inc. (US) 2002-01-02 EP disclosed
WO-2000061562-A1 NEUROTROPHIC SUBSTITUTED PYRIMIDINES KRENITSKY PHARMACEUTICALS INC. (US) 2000-10-19 WO disclosed