SCHEMBL51970

SCHEMBL51970

CCCCc1ccc(C(C)c2ccc(CCCC)cc2O)c(O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.56
HPGD P15428 1/20 0.56
MAPK1 P28482 1/20 0.56
HTT P42858 1/20 0.56
RAB9A P51151 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
PPARA Q07869 1/20 0.47
IGF1R P08069 2/20 0.47
ALOX15 P16050 2/20 0.47
IAPP P10997 1/20 0.45
KAT8 Q9H7Z6 2/20 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
SLC6A3 Q01959 2/20 0.43
KDM4E B2RXH2 1/20 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
SCHEMBL5164400 0.89 NPC1 (0.56) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL16736578 0.86 NPC1 (0.53) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL51630 0.86 NPC1 (0.52) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL31545797 0.83 PPARA (0.56) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL51468 0.81 TRPA1 (0.59) HPGDMAPK1RAB9AIGF1RALOX15
SCHEMBL1052163 0.79 ALOX15 (0.75) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL340409 0.79 NPC1 (0.67) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL30115075 0.79 ALOX15 (0.75) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL2672717 0.79 NPC1 (0.52) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL5168817 0.78 CNR1 (0.55) NPC1HPGDMAPK1HTTRAB9A

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 9 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-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