SCHEMBL17133170

SCHEMBL17133170

CCCCC(CC)COc1c2cc(-c3sc(Br)c4cc(C(=O)C(CC)CCCC)sc34)sc2c(OCC(CC)CCCC)c2cc(-c3sc(Br)c4cc(C(=O)C(CC)CCCC)sc34)sc12

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.31
CYP3A4 P08684 2/20 0.31
CA2 P00918 1/20 0.31
MAPK1 P28482 2/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
THRA P10827 2/20 0.31
THRB P10828 2/20 0.31

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
SCHEMBL18434805 0.96
SCHEMBL20253254 0.90 ALDH1A1 (0.40) ALDH1A1CYP3A4CA2MAPK1TSHR
SCHEMBL20253242 0.85
SCHEMBL11991197 0.84 ALDH1A1 (0.30) ALDH1A1CYP3A4CA2MAPK1TSHR
SCHEMBL17133195 0.84 ALDH1A1 (0.31) ALDH1A1CYP3A4CA2MAPK1TSHR
SCHEMBL15979523 0.83
SCHEMBL15713211 0.82
SCHEMBL16622915 0.80
SCHEMBL17133171 0.79
SCHEMBL16693791 0.77

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
EP-3124519-B1 COPOLYMER AND ORGANIC SOLAR CELL COMPRISING SAME LG CHEMICAL LTD (KR) 2021-05-05 EP disclosed
US-20180166633-A1 COPOLYMER AND ORGANIC SOLAR CELL COMPRISING SAME LG CHEM, LTD. (KR) 2018-06-14 US disclosed
EP-3124519-A1 COPOLYMER AND ORGANIC SOLAR CELL COMPRISING SAME LG Chem, Ltd. (KR) 2017-02-01 EP disclosed
WO-2015147598-A1 COPOLYMER AND ORGANIC SOLAR CELL COMPRISING SAME 주식회사 엘지화학 2015-10-01 WO disclosed