SCHEMBL5280269

SCHEMBL5280269

C1=C(c2ccc(OCCOc3ccccc3)cc2)CCCC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.55
KCNH2 Q12809 3/20 0.55
ALDH1A1 P00352 1/20 0.44
RECQL P46063 1/20 0.44
LTA4H P09960 3/20 0.44
KCNA3 P22001 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
PKM P14618 1/20 0.42
HRH1 P35367 1/20 0.42
ACMSD Q8TDX5 1/20 0.41
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
HRH4 Q9H3N8 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40

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
SCHEMBL10041855 0.84 MAOB (0.50) HRH3KCNH2LTA4HMAOBMAOA
SCHEMBL17072360 0.83 GSTP1 (0.49) HRH3KCNH2LTA4HMAOBMAOA
SCHEMBL11719112 0.80 FFAR4 (0.58) HRH3KCNH2ACMSD
SCHEMBL28317930 0.79 KCNA3 (0.47) ALDH1A1RECQLLTA4HKCNA3PKM
SCHEMBL18911079 0.79 NQO1 (0.50) HRH3KCNH2ALDH1A1LTA4HTDP1
SCHEMBL18905402 0.79 KCNH2 (0.50) HRH3KCNH2ALDH1A1TDP1ACMSD
SCHEMBL11721301 0.79 FFAR4 (0.57) HRH3KCNH2ACMSD
SCHEMBL11721292 0.79 FFAR4 (0.57) HRH3KCNH2ACMSD
SCHEMBL11720605 0.79 FFAR4 (0.57) HRH3KCNH2ACMSD
SCHEMBL8711734 0.79 LTA4H (0.46) HRH3KCNH2LTA4HACMSDMAOA

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 7 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-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