SCHEMBL19928666

SCHEMBL19928666

CCC(C)Nc1cc(N2CCN(CCO)CC2)nc(C)n1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRC P12931 6/20 0.53
FLT3 P36888 3/20 0.52
KIT P10721 2/20 0.52
ABL1 P00519 10/20 0.48
LYN P07948 1/20 0.47
BTK Q06187 1/20 0.47
SIK2 Q9H0K1 11/20 0.46
SIK3 Q9Y2K2 11/20 0.46
SIK1 P57059 9/20 0.46
PKMYT1 Q99640 1/20 0.44
AURKA O14965 1/20 0.43
KDR P35968 1/20 0.43

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
SCHEMBL19928686 0.89 SRC (0.56) SRCFLT3KITABL1LYN
SCHEMBL16809275 0.82 SRC (0.56) SRCFLT3KITABL1LYN
SCHEMBL19928672 0.80 CASP1 (0.40) SRCFLT3KITABL1AURKA
SCHEMBL24122681 0.79 SRC (0.53) SRCFLT3KITABL1LYN
SCHEMBL17469517 0.78 SRC (0.53) SRCFLT3KITABL1LYN
SCHEMBL21952671 0.78 SRC (0.53) SRCFLT3KITABL1LYN
SCHEMBL11960310 0.77 SRC (0.48) SRCFLT3KITABL1LYN
SCHEMBL10064870 0.77 SRC (0.52) SRCFLT3KITABL1LYN
SCHEMBL11981518 0.76 SORD (0.57) SRCFLT3KITABL1LYN
SCHEMBL2237335 0.74 SRC (0.47) SRCFLT3KITABL1LYN

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
US-9908872-B2 Methods to treat lymphoplasmacytic lymphoma DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-03-06 US disclosed