SCHEMBL51630

SCHEMBL51630

CCCCc1ccc(O)c(C(C)c2cc(CCCC)ccc2O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
HPGD P15428 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
KAT8 Q9H7Z6 2/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
IGF1R P08069 3/20 0.47
ALOX15 P16050 3/20 0.47
IAPP P10997 1/20 0.45
PPARA Q07869 1/20 0.44
SKP2 Q13309 1/20 0.43
ESR1 P03372 2/20 0.43
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
TACR2 P21452 2/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 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
SCHEMBL2672717 0.89 NPC1 (0.52) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL51014 0.89 CNR1 (0.60) HPGDMAPK1RAB9ACNR1CNR2
SCHEMBL13000392 0.88 RORC (0.51) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL11414960 0.88 TYR (0.46) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL51970 0.86 NPC1 (0.56) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL31545937 0.84 NPC1 (0.50) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL29079423 0.84 HPGD (0.50) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL28318580 0.83 KAT8 (0.50) KAT8IGF1RALOX15PPARAESR1
SCHEMBL1344744 0.83 CNR1 (0.53) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL7247329 0.83 KAT8 (0.56) KAT8IGF1RALOX15PPARAESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181853-B1 Thermosensitive recording medium JUJO PAPER CO LTD (JP) 2015-09-23 EP disclosed
US-8492308-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2013-07-23 US disclosed
US-8202821-B2 Thermal recording material NIPPON PAPER INDUSTRIES CO., LTD (JP) 2012-06-19 US disclosed
US-8129307-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2012-03-06 US disclosed
US-20110269622-A1 THERMOSENSITIVE RECORDING MEDIUM NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2011-11-03 US disclosed
US-20110130281-A1 THERMOSENSITIVE RECORDING MEDIUM API CORPORATION 2011-06-02 US disclosed
EP-2112001-B1 THERMOSENSITIVE RECORDING MEDIUM JUJO PAPER CO LTD (JP) 2011-05-11 EP disclosed
EP-2261045-A1 HEAT-SENSITIVE RECORDING MEDIUM Nippon Paper Industries Co., Ltd. (JP) 2010-12-15 EP disclosed
EP-2181853-A1 THERMAL RECORDING MATERIAL Nippon Paper Industries Co., Ltd. (JP) 2010-05-05 EP disclosed
US-20100099557-A1 Thermosensitive Recording Medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2010-04-22 US disclosed
US-20090280980-A1 Thermal recording material NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2009-11-12 US disclosed
EP-2072274-A1 HEAT-SENSITIVE RECORDING MATERIAL Nippon Paper Industries CO., LTD. (JP) 2009-06-24 EP disclosed