SCHEMBL5154890

SCHEMBL5154890

CC(C)OOC(=O)OC(C)C.CC(C)c1ccc(OO)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RAB9A P51151 5/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
HPGD P15428 2/20 0.35
XBP1 P17861 1/20 0.35
ACACB O00763 2/20 0.35
ACACA Q13085 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
NPC1 O15118 3/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34

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
Isopropylbenzene SCHEMBL5154885 0.82 TSHR (0.42) RAB9AKMT2AMEN1SMN1; SMN2CA12
SCHEMBL2319733 0.81 TDP1 (0.35) TDP1L3MBTL1RAB9AKMT2AMEN1
SCHEMBL15019624 0.80 RXRA (0.43) TDP1L3MBTL1RAB9AKMT2AMEN1
Bicarbonate SCHEMBL11150406 0.77 RAB9A (0.49) RAB9AKMT2AMEN1SMN1; SMN2RXRA
Acetone SCHEMBL11207944 0.77 RAB9A (0.49) RAB9AKMT2AMEN1SMN1; SMN2RXRA
SCHEMBL18614728 0.77 RAB9A (0.46) RAB9AKMT2AMEN1SMN1; SMN2RXRA
SCHEMBL16628 0.77 RAB9A (0.46) RAB9AKMT2AMEN1SMN1; SMN2RXRA
Methyl Alcohol SCHEMBL7601547 0.75 RAB9A (0.44) RAB9AKMT2AMEN1SMN1; SMN2RXRA
SCHEMBL15144 0.75 TSHR (0.46) CA12CA1CA2CA9KDM4E
Formaldehyde SCHEMBL8074512 0.74 RAB9A (0.44) RAB9AKMT2AMEN1SMN1; SMN2RXRA

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
EP-1143303-B1 Image forming method CANON KK (JP) 2007-01-10 EP disclosed
US-6544708-B2 Heating and pressing a toner image onto a recording material by heat-pressure means to form a fixed image on recording material, the toner comprising toner particles each containing atleast a binder resin and a colorant CANON KABUSHIKI KAISHA (JP) 2003-04-08 US disclosed
US-20020048713-A1 Image forming method CANON KABUSHIKI KAISHA (JP) 2002-04-25 US disclosed
EP-1143303-A2 Image forming method CANON KABUSHIKI KAISHA (JP) 2001-10-10 EP disclosed
EP-0745908-A1 Image forming method and heat fixing method using a toner including a wax CANON KABUSHIKI KAISHA (JP) 1996-12-04 EP disclosed