SCHEMBL5822372

SCHEMBL5822372

CCCc1ccc(Nc2ncc3c(C(=O)NC(C)C)cn(C(C)(C)C)c3n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.47
PTK2 Q05397 2/20 0.44
CSF1R P07333 13/20 0.41
KIT P10721 2/20 0.39
SRC P12931 2/20 0.39
FLT3 P36888 2/20 0.39
INSR P06213 1/20 0.39
PDGFRB P09619 1/20 0.39
CAMK2D Q13557 1/20 0.38
AURKA O14965 1/20 0.38
STAT6 P42226 1/20 0.38
NTRK1 P04629 1/20 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
SCHEMBL3820439 0.88 RET (0.47) RETPTK2NTRK1
SCHEMBL27735796 0.84 PTK2 (0.41) RETPTK2CSF1RCAMK2DAURKA
SCHEMBL5822504 0.83 TRPV1 (0.45) RET
SCHEMBL3819845 0.80 NTRK1 (0.39) RETPTK2NTRK1
SCHEMBL3823247 0.75 MAPT (0.45) NTRK1
SCHEMBL3817641 0.74 DEGS1 (0.39) RETAURKANTRK1
SCHEMBL3822155 0.74 RET (0.43) RETNTRK1
SCHEMBL3820803 0.73 KMT2A (0.43) RETKITNTRK1
SCHEMBL3820620 0.72 MAPT (0.42) RETNTRK1
SCHEMBL3833160 0.71 RET (0.38) RETPTK2

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-2006124897-A2 METHODS AND COMPOSITIONS FOR IMPROVING COGNITION LEXICON GENETICS INCORPORATED (US) 2006-11-23 WO disclosed