SCHEMBL903717

SCHEMBL903717

c1ccc(-c2ccc(-c3nc4cc5[nH]c(-c6ccc(-c7ccccc7)cc6)nc5cc4[nH]3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.66
RAB9A P51151 5/20 0.66
GAA P10253 2/20 0.66
DGAT1 O75907 1/20 0.64
KCNH2 Q12809 1/20 0.64
KDM4E B2RXH2 4/20 0.64
ALDH1A1 P00352 4/20 0.64
HPGD P15428 4/20 0.64
MAPT P10636 4/20 0.64
SMN1; SMN2 Q16637 4/20 0.64
TP53 P04637 2/20 0.64
HSD17B10 Q99714 2/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
GLA P06280 1/20 0.64
HTT P42858 1/20 0.64
GFER P55789 1/20 0.64
RCE1 Q9Y256 1/20 0.64
CYP3A4 P08684 1/20 0.64
MAPK1 P28482 1/20 0.64

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
SCHEMBL3132123 0.90 NPC1 (0.68) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL27442744 0.89 NPC1 (0.70) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL22649095 0.89 NPC1 (0.67) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL21011385 0.88 NPC1 (0.70) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL24075313 0.88 HPSE (0.61) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL24075316 0.88 KDM4E (0.69) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL13299660 0.86 NPC1 (0.72) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL7229354 0.85 NPC1 (0.58) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL22649327 0.85 NPC1 (0.61) NPC1RAB9AGAADGAT1KCNH2
SCHEMBL2252555 0.84 NPC1 (0.92) NPC1RAB9AGAADGAT1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE45850-E1 Composition of organic compounds, optical film and method of production thereof CRYSOPTIX K.K. (JP) 2016-01-19 US disclosed
EP-2638126-B1 NEGATIVE DISPERSION RETARDATION PLATE AND ACHROMATIC CIRCULAR POLARIZER CRYSOPTIX KK (JP) 2015-02-18 EP disclosed
US-8895118-B2 Negative dispersion retardation plate and achromatic circular polarizer CRYSOPTIX K.K. (JP) 2014-11-25 US disclosed
US-20140334002-A1 PATTERNED RETARDER CRYSOPTIX KK (JP) 2014-11-13 US disclosed
US-8512824-B2 Composition of organic compounds, optical film and method of production thereof CRYSOPTIX KK (JP) 2013-08-20 US disclosed
US-8512824-B2 Composition of organic compounds, optical film and method of production thereof CRYSOPTIX KK (JP) 2013-08-20 US disclosed
EP-2331655-B1 COMPOSITION OF ORGANIC COMPOUNDS, OPTICAL FILM AND METHOD OF PRODUCTION THEREOF CRYSOPTIX KK (JP) 2013-07-03 EP disclosed
US-20130003178-A1 THREE-DIMENSIONAL CIRCULAR POLARIZATION EYEGLASSES CRYSOPTIX KK (JP) 2013-01-03 US disclosed
WO-2013003780-A1 THREE-DIMENSIONAL CIRCULAR POLARIZATION EYEGLASSES CRYSOPTIX KK (JP) 2013-01-03 WO disclosed
WO-2012064618-A1 NEGATIVE DISPERSION RETARDATION PLATE AND ACHROMATIC CIRCULAR POLARIZER CRYSOPTIX KK (JP) 2012-05-18 WO disclosed
US-20120113380-A1 NEGATIVE DISPERSION RETARDATION PLATE AND ACHROMATIC CIRCULAR POLARIZER CRYSOPTIX KK (JP) 2012-05-10 US disclosed
US-20120099052-A1 RETARDER AND LIQUID CRYSTAL DISPLAY COMPRISING THE SAME CRYSOPTIX KK (JP) 2012-04-26 US disclosed
WO-2012052950-A1 RETARDER AND LIQUID CRYSTAL DISPLAY COMPRISING THE SAME CRYSOPTIX KK (JP) 2012-04-26 WO disclosed
WO-2012044867-A1 PATTERNED RETARDER CRYSOPTIX KK (JP) 2012-04-05 WO disclosed
US-20120081784-A1 PATTERNED RETARDER CRYSOPTIX KK (JP) 2012-04-05 US disclosed
US-20100085521-A1 Composition of Organic Compounds, Optical Film and Method of Production Thereof CRYSOPTIX KK (JP) 2010-04-08 US disclosed
US-20100085521-A1 Composition of Organic Compounds, Optical Film and Method of Production Thereof CRYSOPTIX KK (JP) 2010-04-08 US disclosed
WO-2010020928-A2 COMPOSITION OF ORGANIC COMPOUNDS, OPTICAL FILM AND METHOD OF PRODUCTION THEREOF CRYSOPTIX KK (JP) 2010-02-25 WO disclosed