SCHEMBL9768704

SCHEMBL9768704

CCOc1ccc(OCC(C)Oc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.58
LMNA P02545 2/20 0.52
NQO1 P15559 1/20 0.50
RELA Q04206 1/20 0.49
MAOA P21397 1/20 0.47
PTGS1 P23219 1/20 0.47
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
XBP1 P17861 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42

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
SCHEMBL9768614 0.93 NQO1 (0.58) LTA4HLMNANQO1RELAMAPT
SCHEMBL2505117 0.91 LMNA (0.61) LMNAMAOAPTGS1MTNR1AMTNR1B
SCHEMBL8670952 0.86 LMNA (0.52) LMNAMAOAPTGS1POLBMAPT
SCHEMBL8436949 0.86 LMNA (0.52) LTA4HLMNAMAOAPTGS1MAPT
SCHEMBL8436935 0.86 LMNA (0.52) LTA4HLMNAMAOAPTGS1MAPT
SCHEMBL9344357 0.86 NQO1 (0.50) NQO1POLBMAPTHPGDMTNR1A
SCHEMBL9343776 0.86 NQO1 (0.50) NQO1POLBMAPTHPGDMTNR1A
SCHEMBL9348566 0.86 NQO1 (0.50) NQO1POLBMAPTHPGDMTNR1A
SCHEMBL10704258 0.84 LMNA (0.55) LTA4HLMNAMAOAPTGS1POLB
SCHEMBL9348181 0.84 NQO1 (0.48) LTA4HNQO1L3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4994431-A Containing colorless dye precursor, color developer and 1-alkoxy-phenoxy-2-aryloxypropane sensitizer; preservation stability, high sensitivity FUJI PHOTO FILM CO., LTD. (JP) 1991-02-19 US disclosed
EP-0357409-A2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed