SCHEMBL14552156

SCHEMBL14552156

Cc1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccccc4)c4cccc(C)c4)c4ccccc34)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
CRHR1 P34998 2/20 0.33
HSD17B1 P14061 2/20 0.33
HSD17B2 P37059 2/20 0.33
CNR2 P34972 2/20 0.33
SIGMAR1 Q99720 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 2/20 0.32

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
SCHEMBL7086068 1.00 RXRA (0.41) RXRARXRBCRHR1HSD17B1HSD17B2
SCHEMBL7085931 1.00 RXRA (0.41) RXRARXRBCRHR1HSD17B1HSD17B2
SCHEMBL7088898 0.92 SIGMAR1 (0.38) RXRARXRBCRHR1SIGMAR1CYP1A2
SCHEMBL7482902 0.91 HSD17B1 (0.39) HSD17B1HSD17B2SIGMAR1SLC6A2SLC6A4
SCHEMBL13242040 0.90 SIGMAR1 (0.37) RXRARXRBSIGMAR1SLC6A2SLC6A4
SCHEMBL14552158 0.89 CETP (0.37) RXRARXRBCNR2MAPTCYP1A2
SCHEMBL10128586 0.88 ACHE (0.39) SIGMAR1SLC6A2SLC6A4ALDH1A1MAPT
SCHEMBL17264027 0.87 SIGMAR1 (0.32) RXRARXRBCRHR1SIGMAR1ALDH1A1
SCHEMBL401883 0.87 HSD17B1 (0.38) CRHR1HSD17B1HSD17B2CNR2SIGMAR1
SCHEMBL2446726 0.86 RXRA (0.46) RXRARXRBALDH1A1MAPTKDM4E

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
US-9397294-B2 Vertically phase-separating semiconducting organic material layers SOLVAY USA, INC. (US) 2016-07-19 US disclosed
US-9397294-B2 Vertically phase-separating semiconducting organic material layers SOLVAY USA, INC. (US) 2016-07-19 US disclosed
WO-2013006478-A1 VERTICALLY PHASE-SEPARATING SEMICONDUCTING ORGANIC MATERIAL LAYERS PLEXTRONICS, INC. (US) 2013-01-10 WO disclosed
US-20130009137-A1 VERTICALLY PHASE-SEPARATING SEMICONDUCTING ORGANIC MATERIAL LAYERS PLEXTRONICS, INC. 2013-01-10 US disclosed
US-20130009137-A1 VERTICALLY PHASE-SEPARATING SEMICONDUCTING ORGANIC MATERIAL LAYERS PLEXTRONICS, INC. 2013-01-10 US disclosed