SCHEMBL2208315

SCHEMBL2208315

CCCCCCCCOc1ccc(-c2ccc(OCCCCCCCC)c(Br)c2)cc1Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.55
PTPN1 P18031 1/20 0.55
PTPN6 P29350 1/20 0.55
THRA P10827 2/20 0.53
THRB P10828 2/20 0.53
S1PR3 Q99500 2/20 0.49
S1PR2 O95136 1/20 0.49
S1PR1 P21453 1/20 0.49
LPAR2 Q9HBW0 1/20 0.49
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL9398800 0.91 PTPN11 (0.49) PTPN11PTPN1PTPN6THRATHRB
SCHEMBL17485630 0.86 CYP2D6 (0.53) PTPN11PTPN1PTPN6TDP1KDM4E
SCHEMBL9398737 0.84 PTPN11 (0.51) PTPN11PTPN1PTPN6THRBS1PR3
SCHEMBL10877882 0.84 PTPN11 (0.51) PTPN11PTPN1PTPN6THRBS1PR3
SCHEMBL28018164 0.84 THRA (0.52) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL8000546 0.84 THRA (0.52) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL13957128 0.83 PTPN11 (0.55) PTPN11PTPN1PTPN6S1PR3ALDH1A1
SCHEMBL28319408 0.83 PTPN11 (0.55) PTPN11PTPN1PTPN6S1PR3ALDH1A1
SCHEMBL2856448 0.83 PTPN11 (0.55) PTPN11PTPN1PTPN6S1PR3ALDH1A1
SCHEMBL1776071 0.83 PTPN11 (0.55) PTPN11PTPN1PTPN6S1PR3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7982212-B2 Copolymer and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-19 US disclosed
US-7982212-B2 Copolymer and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-19 US disclosed
US-20100176376-A1 COPOLYMER AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY , LIMITED (JP) 2010-07-15 US disclosed
US-20100176376-A1 COPOLYMER AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY , LIMITED (JP) 2010-07-15 US disclosed