SCHEMBL7046679

SCHEMBL7046679

CC(=O)N(C(C)CN(C)C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21.CC(=O)N(CC(C)N(C)C)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 7/20 0.51
TEK Q02763 6/20 0.51
SRC P12931 5/20 0.51
KDR P35968 5/20 0.51
HCK P08631 11/20 0.48
FLT3 P36888 8/20 0.48
BTK Q06187 2/20 0.47

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
SCHEMBL6467047 0.94 LCK (0.57) LCKTEKSRCKDRHCK
SCHEMBL6463363 0.94 TEK (0.57) LCKTEKSRCKDRHCK
SCHEMBL6464527 0.86 TEK (0.56) LCKTEKSRCKDRHCK
SCHEMBL6459977 0.86 TEK (0.60) LCKTEKSRCKDRHCK
SCHEMBL6459099 0.86 TEK (0.60) LCKTEKSRCKDRHCK
SCHEMBL6459152 0.86 LCK (0.55) LCKTEKSRCKDRHCK
SCHEMBL6466144 0.85 LCK (0.59) LCKTEKSRCKDRHCK
SCHEMBL6878831 0.85 TEK (0.59) LCKTEKSRCKDRHCK
SCHEMBL6468059 0.85 LCK (0.59) LCKTEKSRCKDRHCK
SCHEMBL6461304 0.83 LCK (0.56) LCKTEKSRCKDRHCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004100868-A2 METHOD OF TREATING TRANSPLANT REJECTION ABBOTT LABORATORIES (US) 2004-11-25 WO disclosed