SCHEMBL9808262

SCHEMBL9808262

COc1ccc(OCCCCOc2ccc(OC)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.62
L3MBTL1 Q9Y468 4/20 0.62
TDP1 Q9NUW8 1/20 0.62
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA7 P43166 1/20 0.61
CA9 Q16790 1/20 0.61
CA14 Q9ULX7 1/20 0.61
DRD2 P14416 1/20 0.59
DRD4 P21917 1/20 0.59
DRD3 P35462 1/20 0.59
KCNH2 Q12809 1/20 0.57
APP P05067 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
ALDH1A1 P00352 2/20 0.55
HPGD P15428 2/20 0.55
HSD17B10 Q99714 1/20 0.55

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
SCHEMBL30514009 0.97 MAPT (0.60) MAPTL3MBTL1TDP1CA12CA1
SCHEMBL14984020 0.97 MAPT (0.60) MAPTL3MBTL1TDP1CA12CA1
SCHEMBL8434882 0.94 CA12 (0.61) MAPTL3MBTL1TDP1CA12CA1
SCHEMBL13313234 0.93 MAPT (0.56) MAPTL3MBTL1TDP1CA12CA1
SCHEMBL1343630 0.92 CA12 (0.65) MAPTL3MBTL1TDP1CA12CA1
1-Methoxy-4-Pentoxybenzene SCHEMBL7778996 0.91 NR5A1 (0.64) MAPTL3MBTL1TDP1DRD2DRD4
SCHEMBL5660131 0.91 MAPT (0.59) MAPTL3MBTL1TDP1CA12CA1
SCHEMBL5287776 0.91 KCNA3 (0.73) MAPTL3MBTL1TDP1DRD2DRD4
1-Butyloxy-4-Methoxybenzene SCHEMBL1047291 0.90 AHR (0.61) MAPTL3MBTL1TDP1CA12CA1
SCHEMBL23128627 0.89 NR5A1 (0.68) MAPTL3MBTL1TDP1NPC1RAB9A

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-4985393-A Bis/hydroxyphenylthio/ Compounds KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1991-01-15 US disclosed
EP-0373561-A2 Heat sensitive recording material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1990-06-20 EP disclosed