SCHEMBL14366552

SCHEMBL14366552

Cn1nc(N)c2c(-c3ccc([N+](=O)O)cc3)cc(CO)nc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 6/20 0.39
KIT P10721 6/20 0.39
BLK P51451 5/20 0.39
HTT P42858 1/20 0.36
CFTR P13569 2/20 0.36
KDR P35968 11/20 0.35
ABL1 P00519 8/20 0.35
SRC P12931 7/20 0.35
FLT3 P36888 6/20 0.35
FLT1 P17948 5/20 0.35
FLT4 P35916 5/20 0.35
LYN P07948 4/20 0.35
LCK P06239 4/20 0.35
FYN P06241 1/20 0.35
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
IKBKB O14920 1/20 0.32
PLK4 O00444 1/20 0.31
AURKA O14965 1/20 0.31

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
SCHEMBL12973252 0.89 MAPT (0.45) CSF1RKITBLKHTTCFTR
SCHEMBL2818604 0.75 IKBKB (0.44) CSF1RKITBLKHTTLMNA
SCHEMBL30367366 0.74 HTT (0.41) CSF1RKITBLKHTTLMNA
SCHEMBL2818684 0.70 RAB9A (0.50) HTTPOLBMAPT
SCHEMBL2821619 0.69 CSF1R (0.45) CSF1RKITBLKHTTKDR
SCHEMBL30585421 0.68 HRH4 (0.47) HTTLMNAMAPTIKBKBMAP4K4
SCHEMBL13329767 0.67 LMNA (0.53) HTTLMNAPOLBMAPTMKNK2
SCHEMBL2816137 0.67 MEN1 (0.47) LMNAPOLBMAPT
SCHEMBL30585433 0.66 ALDH1A1 (0.46) HTTLMNAMAPTMAP4K4
SCHEMBL2819164 0.66 CSF1R (0.40) CSF1RKITBLKHTTKDR

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-2007144204-A1 SUBSTITUTED AMINOPYRAZOLOPYRIDINES AND SALTS THEREOF, THEIR PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-12-21 WO disclosed