SCHEMBL17655323

SCHEMBL17655323

CC(C)(OS)OCCCCOc1cccc(NC(=O)N2CCOc3ccc(-c4cccc(C(F)(F)F)c4)nc32)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 3/20 0.42
▸ GPR52 Q9Y2T5 1/20 0.35
▸ CNR2 P34972 2/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ GPR142 Q7Z601 1/20 0.33
▸ CXCR1 P25024 1/20 0.33
▸ PHGDH O43175 1/20 0.33
▸ STAT3 P40763 1/20 0.32
▸ EPHX2 P34913 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ DGAT1 O75907 1/20 0.32
▸ FFAR4 Q5NUL3 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ EGFR P00533 1/20 0.32
▸ GRIN1 Q05586 1/20 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
SCHEMBL17655412 0.89 FGFR4 (0.46) FGFR4GPR52CNR2CA2CA9
SCHEMBL12959030 0.84 FGFR4 (0.45) FGFR4GPR52CNR2CA2CA9
SCHEMBL12805950 0.84 FGFR4 (0.45) FGFR4GPR52CNR2CA2CA9
SCHEMBL12805953 0.84 FGFR4 (0.45) FGFR4GPR52CNR2CA2CA9
SCHEMBL12653771 0.81 FGFR4 (0.54) FGFR4CNR2CA2CA9GPR142
SCHEMBL1817583 0.80 FGFR4 (0.43) FGFR4CNR2CA2CA9GPR142
SCHEMBL1817581 0.80 FGFR4 (0.43) FGFR4CNR2CA2CA9GPR142
SCHEMBL12654380 0.78 FGFR4 (0.52) FGFR4CNR2CA2CA9GPR142
SCHEMBL12958958 0.78 CNR2 (0.46) FGFR4CNR2EPHX2TDP1SCN9A
SCHEMBL12654402 0.77 FGFR4 (0.46) FGFR4CNR2CA2CA9GPR142

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2493888-B1 BICYCLIC PYRIDINES AND ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2016-04-06 — — EP disclosed
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