SCHEMBL17501646

SCHEMBL17501646

FC(F)(F)C(F)(F)C(F)(F)CNc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.41
PTPN1 P18031 1/20 0.36
PTPRZ1 P23471 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
PDK1 Q15118 2/20 0.34
PDK2 Q15119 2/20 0.34
PDK3 Q15120 2/20 0.34
PDK4 Q16654 2/20 0.34
CTSD P07339 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MAN1B1 Q9UKM7 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL10507363 0.92 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1PTPN1PTPRZ1
SCHEMBL5400106 0.80 APP (0.39) ALDH1A1MAPTL3MBTL1CA12CA2
SCHEMBL6582317 0.78 MAPT (0.45) ALDH1A1MAPTL3MBTL1TDP1
SCHEMBL549076 0.78 ALDH1A1 (0.54) ALDH1A1MAPTL3MBTL1PTPN1PTPRZ1
SCHEMBL15114128 0.74 MAPT (0.50) ALDH1A1MAPTL3MBTL1PTPN1PTPRZ1
SCHEMBL8098495 0.73 ALDH1A1 (0.55) ALDH1A1MAPTL3MBTL1PTPN1PTPRZ1
SCHEMBL11248973 0.72 CA2 (0.47) ALDH1A1CA2
SCHEMBL15114122 0.71 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1PTPN1PTPRZ1
SCHEMBL3030845 0.71 MAPT (0.33) ALDH1A1MAPTL3MBTL1PDK1PDK2
SCHEMBL11317356 0.70 CA2 (0.36) ALDH1A1CA2HSD17B10

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-2985801-B1 PHOTOACTIVE LAYER, ORGANIC SOLAR CELL COMPRISING SAME, AND MANUFACTURING METHOD THEREFOR LG CHEMICAL LTD (KR) 2019-08-28 EP disclosed
US-9923144-B2 Photoactive layer, organic solar cell comprising same, and manufacturing method therefor LG CHEM, LTD. (KR) 2018-03-20 US disclosed
US-20160087214-A1 PHOTOACTIVE LAYER, ORGANIC SOLAR CELL COMPRISING SAME, AND MANUFACTURING METHOD THEREFOR LG CHEM, LTD. (KR) 2016-03-24 US disclosed
EP-2985801-A1 PHOTOACTIVE LAYER, ORGANIC SOLAR CELL COMPRISING SAME, AND MANUFACTURING METHOD THEREFOR LG Chem, Ltd. (KR) 2016-02-17 EP disclosed