SCHEMBL7166376

SCHEMBL7166376

CCCCCC1=C(C(C)=O)C(=O)c2ccccc2C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.48
HSP90AA1 P07900 3/20 0.47
HSP90AB1 P08238 1/20 0.47
MAPT P10636 6/20 0.47
NPSR1 Q6W5P4 6/20 0.47
LMNA P02545 5/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
KDM4E B2RXH2 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
XBP1 P17861 1/20 0.47
MAPK1 P28482 1/20 0.47
MPI P34949 1/20 0.47
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR4 P22455 1/20 0.46

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
SCHEMBL170030 0.81 FGFR1 (0.50) PTPN1HSP90AA1HSP90AB1SMN1; SMN2RAB9A
SCHEMBL27570013 0.79 ALDH1A1 (0.51) PTPN1HSP90AA1HSP90AB1MAPTNPSR1
Acequinocyl SCHEMBL29368518 0.78 PTPN1 (0.48) PTPN1ALOX5MPEG1
Acequinocyl SCHEMBL28131 0.78 PTPN1 (0.48) PTPN1ALOX5MPEG1
Acequinocyl SCHEMBL4052105 0.78 PTPN1 (0.48) PTPN1ALOX5MPEG1
SCHEMBL11541723 0.78 PTPN1 (0.48) PTPN1ALOX5MPEG1
SCHEMBL30245093 0.78 ALOX5 (0.55) PTPN1MAPTNPSR1MEN1KMT2A
SCHEMBL30996030 0.78 ALOX5 (0.55) PTPN1MAPTNPSR1MEN1KMT2A
SCHEMBL29879118 0.78 ALOX5 (0.55) PTPN1MAPTNPSR1MEN1KMT2A
SCHEMBL9444208 0.78 ALOX5 (0.55) PTPN1MAPTNPSR1MEN1KMT2A

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
EP-0764886-B1 Electrophotosensitive material containing a naphthoquinone derivative KYOCERA MITA CORP (JP) 2003-09-03 EP disclosed