SCHEMBL12141663

SCHEMBL12141663

COC(Cc1ccccc1)(C(C)=O)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
PTPN1 P18031 4/20 0.46
PTPRC P08575 1/20 0.45
MAPK1 P28482 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
RECQL P46063 1/20 0.43
MAOB P27338 1/20 0.42
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RAB9A P51151 1/20 0.41
PTPN2 P17706 1/20 0.41
PTPRA P18433 1/20 0.41
PTPRB P23467 1/20 0.41

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
SCHEMBL13688707 0.84 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1PTPN1MAPK1
SCHEMBL12141665 0.82 ALDH1A1 (0.47) ALDH1A1PTPN1SLC6A2RECQLMAOB
SCHEMBL12141687 0.81 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1PTPN1PTPRC
SCHEMBL7431853 0.80 ALDH1A1 (0.57) ALDH1A1KMT2AMEN1PTPN1L3MBTL1
SCHEMBL28420568 0.77 PTPRB (0.54) ALDH1A1KMT2AMEN1PTPN1PTPRC
SCHEMBL934104 0.77 SMN1; SMN2 (0.52) ALDH1A1PTPN1SLC6A2RECQLCYP3A4
SCHEMBL11604912 0.76 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1PTPN1MAPK1
SCHEMBL23135840 0.76 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1PTPN1PTPRC
SCHEMBL28410551 0.76 ALDH1A1 (0.61) ALDH1A1KMT2AMEN1PTPN1PTPRC
SCHEMBL28371759 0.76 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1PTPN1PTPRC

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067136-B2 Charge control agent, toner, image forming method, and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2011-11-29 US disclosed
US-7589156-B2 Polyhydroxyalkanoic acid having ester, carboxyl or sulfonic acid group, and producing method therefor CANON KABUSHIKI KAISHA (JP) 2009-09-15 US disclosed
US-20090202927-A1 Charge control agent, toner, image forming method, and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2009-08-13 US disclosed
US-7510813-B2 Resin-coated carrier for electrophotographic developer CANON KABUSHIKI KAISHA (JP) 2009-03-31 US disclosed
US-20070117937-A1 Polyhydroxyalkanoic acid having ester, carboxyl or sulfonic acid group and producing method thereor CANON KABUSHIKI KAISHA (JP) 2007-05-24 US disclosed