SCHEMBL2994232

SCHEMBL2994232

CC(=O)Cc1ccc(F)cc1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.50
TDP1 Q9NUW8 3/20 0.47
ATM Q13315 1/20 0.47
PDK1 Q15118 1/20 0.46
MAPT P10636 5/20 0.43
ALDH1A1 P00352 4/20 0.42
USP10 Q14694 1/20 0.41
USP7 Q93009 1/20 0.41
USP47 Q96K76 1/20 0.41
L3MBTL1 Q9Y468 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
KCNMA1 Q12791 1/20 0.41
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDE7A Q13946 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
SCHEMBL30410464 1.00 CYP1A2 (0.50) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL6973093 0.89 CYP1A2 (0.49) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL27707665 0.89 TDP1 (0.49) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL3010413 0.87 ATM (0.51) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL2989584 0.85 CYP1A2 (0.69) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL2989578 0.85 CYP1A2 (0.69) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL2568261 0.84 CYP1A2 (0.48) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL7594106 0.84 CYP1A2 (0.50) CYP1A2TDP1ATMPDK1MAPT
SCHEMBL27719772 0.83 PDGFRB (0.56) CYP1A2TDP1ATMMAPTALDH1A1
SCHEMBL16397397 0.83 MAPT (0.44) CYP1A2TDP1ATMMAPTALDH1A1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108203385-B Method for preparing 3- (4-fluoro-2-nitrophenyl) acetone 青岛恒宁生物科技有限公司 2021-03-09 CN claimed
CN-101468964-B Processes for producing indole compound NISSAN CHEMICAL IND LTD 2011-05-11 CN claimed
CN-100577659-C Processes for producing indole compound NISSAN CHEMICAL IND LTD 2010-01-06 CN claimed
CN-101468964-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2009-07-01 CN claimed
EP-1829872-A1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS Nissan Chemical Industries, Ltd. (JP) 2007-09-05 EP claimed
CN-1896075-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2007-01-17 CN claimed
CN-1286832-C Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2006-11-29 CN claimed
CN-1646522-A Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2005-07-27 CN claimed
WO-2023080193-A1 METHOD FOR PRODUCING INDOLE COMPOUND 日産化学株式会社 2023-05-11 WO disclosed
CN-108203385-B Method for preparing 3- (4-fluoro-2-nitrophenyl) acetone 青岛恒宁生物科技有限公司 2021-03-09 CN disclosed
CN-108203385-B Method for preparing 3- (4-fluoro-2-nitrophenyl) acetone 青岛恒宁生物科技有限公司 2021-03-09 CN disclosed
CN-108203385-B Method for preparing 3- (4-fluoro-2-nitrophenyl) acetone 青岛恒宁生物科技有限公司 2021-03-09 CN disclosed
CN-108203385-A A kind of method for preparing 3- (the fluoro- 2- nitrobenzophenones of 4-) acetone 海利尔药业集团股份有限公司 2018-06-26 CN disclosed
EP-1829872-B1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS NISSAN CHEMICAL IND LTD (JP) 2015-07-29 EP disclosed
CN-1896075-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2007-01-17 CN disclosed
CN-1286832-C Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2006-11-29 CN disclosed
CN-1286832-C Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2006-11-29 CN disclosed
CN-1646522-A Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2005-07-27 CN disclosed
CN-1646522-A Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2005-07-27 CN disclosed
WO-2003082860-A1 PROCESSES FOR PRODUCING INDOLE COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-10-09 WO disclosed