SCHEMBL9348551

SCHEMBL9348551

COc1ccc(OCC(C)Oc2ccccc2OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 2/20 0.44
CYP2C9 P11712 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HPGD P15428 2/20 0.43

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
SCHEMBL9348261 0.86 LMNA (0.56) MTNR1AMTNR1BL3MBTL1TDP1KMT2A
SCHEMBL8436949 0.83 LMNA (0.52) MTNR1AMTNR1BMAPTKMT2ATSHR
SCHEMBL8436935 0.83 LMNA (0.52) MTNR1AMTNR1BMAPTKMT2ATSHR
SCHEMBL418159 0.82 CYP2C9 (0.52) MTNR1AMTNR1BALDH1A1MAPK1HTT
SCHEMBL21984678 0.76 POLB (0.41) ALDH1A1MAPK1MAPTKMT2ATSHR
SCHEMBL9344357 0.76 NQO1 (0.50) MTNR1AMTNR1BALDH1A1MAPK1MAPT
SCHEMBL9343776 0.76 NQO1 (0.50) MTNR1AMTNR1BALDH1A1MAPK1MAPT
SCHEMBL9348566 0.76 NQO1 (0.50) MTNR1AMTNR1BALDH1A1MAPK1MAPT
SCHEMBL8944273 0.75 KMT2A (0.42) MTNR1AMTNR1BL3MBTL1MAPTKMT2A
SCHEMBL9345650 0.75 MAPT (0.46) MTNR1AMTNR1BL3MBTL1ALDH1A1MAPT

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
JP-2070481-A None JP disclosed
EP-0357409-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 1994-07-20 EP disclosed
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
JP-H0270481-A THERMAL RECORDING MATERIAL FUJI PHOTO FILM CO LTD 1990-03-09 JP disclosed
EP-0357409-A2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed