SCHEMBL5287776

SCHEMBL5287776

COc1ccc(OCCCCOc2ccccc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.73
DRD2 P14416 1/20 0.72
DRD4 P21917 1/20 0.72
DRD3 P35462 1/20 0.72
MAPT P10636 3/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
TDP1 Q9NUW8 1/20 0.65
CA4 P22748 1/20 0.64
LTA4H P09960 4/20 0.62
HPGD P15428 1/20 0.58
ATM Q13315 1/20 0.58
KCNH2 Q12809 2/20 0.57
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HDAC8 Q9BY41 1/20 0.57

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
SCHEMBL28312915 0.98 DRD2 (0.70) KCNA3DRD2DRD4DRD3MAPT
SCHEMBL4337645 0.93 DRD2 (0.69) KCNA3DRD2DRD4DRD3MAPT
SCHEMBL9808262 0.91 MAPT (0.62) KCNA3DRD2DRD4DRD3MAPT
Anisole SCHEMBL28123071 0.90 LTA4H (0.72) KCNA3DRD2DRD4DRD3MAPT
SCHEMBL30514009 0.88 MAPT (0.60) KCNA3DRD2DRD4DRD3MAPT
SCHEMBL14984020 0.88 MAPT (0.60) KCNA3DRD2DRD4DRD3MAPT
Anisole SCHEMBL28183589 0.88 LTA4H (0.70) KCNA3DRD2DRD4DRD3CA4
Anisole SCHEMBL28238260 0.88 LTA4H (0.70) KCNA3DRD2DRD4DRD3CA4
Anisole SCHEMBL28309699 0.88 LTA4H (0.70) KCNA3DRD2DRD4DRD3CA4
Anisole SCHEMBL28183591 0.88 LTA4H (0.70) KCNA3DRD2DRD4DRD3CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006138653-A9 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORP (US) 2007-03-01 WO disclosed
US-20060293181-A1 Thermal recording materials and methods of making and using the same NASHUA CORPORATION 2006-12-28 US disclosed
WO-2006138653-A1 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORPORATION (US) 2006-12-28 WO disclosed
US-RE36321-E INCLUDING DIARYL DIETHER COMPOUND KANSAKI PAPER MANUFACTURING CO., LTD. (JP) 1999-09-28 US disclosed
EP-0141170-B1 HEAT-SENSITIVE RECORDING MATERIAL KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1987-05-13 EP disclosed
US-4659643-A A PHENOXY COMPOUND KANZAKI PAPER MANUFACTURING CO. LTD. (JP) 1987-04-21 US disclosed
US-4531140-A Heat-sensitive recording material Kansaki Paper Manufacturing Co. Ltd. (JP) 1985-07-23 US disclosed
EP-0141170-A2 Heat-sensitive recording material KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1985-05-15 EP disclosed