SCHEMBL1999616

SCHEMBL1999616

O=C(OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1ccccc1C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.47
NPSR1 Q6W5P4 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 5/20 0.44
CYP3A4 P08684 2/20 0.43
NPC1 O15118 1/20 0.43
TDP1 Q9NUW8 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 2/20 0.41
TP53 P04637 1/20 0.41
HIF1A Q16665 1/20 0.41
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.38
PDK2 Q15119 1/20 0.36

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
SCHEMBL1995807 0.85 MAPK1 (0.61) TSHRKMT2AALDH1A1NPC1TDP1
SCHEMBL1993316 0.83 MAPK1 (0.59) TSHRKMT2AALDH1A1NPC1TDP1
SCHEMBL1998327 0.83 MAPK1 (0.59) TSHRKMT2AALDH1A1NPC1TDP1
SCHEMBL14522616 0.83 TSHR (0.51) TSHRNPSR1MEN1KMT2AALDH1A1
SCHEMBL1993751 0.82 MAPK1 (0.47) TSHRMEN1KMT2AALDH1A1CYP3A4
SCHEMBL1996152 0.82 ALDH1A1 (0.49) TSHRNPSR1MEN1KMT2AALDH1A1
SCHEMBL1998060 0.80 MAPK1 (0.46) TSHRKMT2AALDH1A1NPC1TDP1
SCHEMBL2003037 0.80 TSHR (0.55) TSHRNPSR1MEN1KMT2AALDH1A1
SCHEMBL1996387 0.79 MAPK1 (0.62) TSHRKMT2AALDH1A1NPC1TDP1
SCHEMBL24065907 0.77 ALDH1A1 (0.48) TSHRNPSR1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2338935-B1 FLUORINE-CONTAINING COPOLYMER COMPOSITION AND PROCESS FOR PRODUCTION THEREOF ASAHI GLASS CO LTD (JP) 2012-12-12 EP disclosed
EP-2338935-A1 FLUORINE-CONTAINING COPOLYMER COMPOSITION AND PROCESS FOR PRODUCTION THEREOF ASAHI GLASS COMPANY, LIMITED (JP) 2011-06-29 EP disclosed