SCHEMBL8469667

SCHEMBL8469667

Cc1ccc(Nc2nc3cc(Cl)ccc3n3cn[c]c23)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.41
NPC1 O15118 1/20 0.41
KMT2A Q03164 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40
POLB P06746 2/20 0.38
MEN1 O00255 2/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 3/20 0.38
GAA P10253 1/20 0.38
LYN P07948 1/20 0.35
BTK Q06187 1/20 0.35
THRB P10828 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8469678 0.82 LCK (0.47) LCK
SCHEMBL7970038 0.80 LCK (0.64) LCKLYNBTK
SCHEMBL7979769 0.74 LCK (0.39) LCKNPC1KMT2ARXFP1POLB
SCHEMBL7970124 0.66 LCK (0.72) LCK
SCHEMBL7970605 0.65 KMT2A (0.42) LCKNPC1KMT2ARXFP1POLB
SCHEMBL7969605 0.65 LCK (0.64) LCKKMT2ALYNBTK
SCHEMBL7970071 0.65 LCK (0.72) LCKLYNBTK
SCHEMBL7982979 0.65 LCK (0.79) LCKNPC1POLBLYNBTK
SCHEMBL21037121 0.61 RAPGEF4 (0.55) NPC1KMT2APOLBMEN1RAB9A
SCHEMBL13415857 0.60 DUSP26 (0.62) KMT2APOLBMEN1MAPTSMN1; SMN2

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-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO claimed