SCHEMBL6073373

SCHEMBL6073373

CCOC(=O)C(C(=O)OCC)c1ccc(C(F)(F)F)cc1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
ATM Q13315 1/20 0.47
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2C9 P11712 1/20 0.43
POLB P06746 2/20 0.42
PDE2A O00408 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GPR35 Q9HC97 1/20 0.40
EPHX2 P34913 1/20 0.39

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
SCHEMBL6073339 0.89 CFTR (0.44) CFTRL3MBTL1MAPTLMNAATM
SCHEMBL6072863 0.79 HPD (0.50) L3MBTL1MAPTLMNAALDH1A1KDM4E
SCHEMBL1043699 0.79 NPSR1 (0.49) MAPTKDM4EPOLBMEN1KMT2A
SCHEMBL11336074 0.77 CFTR (0.70) CFTRL3MBTL1MAPTLMNAATM
SCHEMBL20811536 0.76 PDE2A (0.55) L3MBTL1ALDH1A1CYP1A2CYP2C19CYP2C9
SCHEMBL29453116 0.76 PDE2A (0.55) L3MBTL1ALDH1A1CYP1A2CYP2C19CYP2C9
SCHEMBL6072903 0.76 HPD (0.47) L3MBTL1MAPTLMNAALDH1A1KDM4E
SCHEMBL6809652 0.75 MMP8 (0.48) MAPTKDM4EPOLBMEN1KMT2A
SCHEMBL4748728 0.75 NPSR1 (0.46) MAPTALDH1A1KDM4ECYP1A2CYP2C19
SCHEMBL1043810 0.74 CES2 (0.49) MAPTATMALDH1A1HPGDCYP1A2

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-2006032987-A1 INDOLINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF ARTERIOSCLEROSIS PFIZER PRODUCTS INC. (US) 2006-03-30 WO disclosed