SCHEMBL17058202

SCHEMBL17058202

CON1CCN(c2cnn(-c3cc(F)cc(F)c3)c(=O)c2OCC2(C)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 2/20 0.36
▸ SLC2A3 P11169 2/20 0.36
▸ MCHR1 Q99705 7/20 0.34
▸ NPBWR1 P48145 9/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ NCOA2 Q15596 1/20 0.33
▸ NCOA1 Q15788 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ LMNA P02545 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ GAA P10253 1/20 0.30

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
SCHEMBL17058015 0.89 SLC2A1 (0.35) SLC2A1SLC2A3MCHR1NPBWR1NPSR1
SCHEMBL17058382 0.89 SLC2A1 (0.35) SLC2A1SLC2A3MCHR1NPBWR1NPSR1
SCHEMBL14899899 0.87 USP2 (0.35) SLC2A1SLC2A3MCHR1CYP3A4CYP2C19
SCHEMBL11945434 0.87 ALDH1A1 (0.45) SLC2A1SLC2A3NPSR1POLBCYP3A4
SCHEMBL11945379 0.87 NPSR1 (0.39) SLC2A1SLC2A3MCHR1NPSR1POLB
SCHEMBL17058276 0.87 SLC2A1 (0.34) SLC2A1SLC2A3MCHR1NPSR1POLB
SCHEMBL11944688 0.84 POLB (0.38) SLC2A1SLC2A3MCHR1NPSR1POLB
SCHEMBL11944602 0.83 POLB (0.37) SLC2A1SLC2A3MCHR1NPSR1POLB
SCHEMBL11946017 0.82 MAPT (0.38) SLC2A1SLC2A3NPSR1POLBCYP3A4
SCHEMBL17058351 0.82 CA12 (0.35) SLC2A1SLC2A3NPBWR1NPSR1POLB

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-2137179-B1 PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS MERCK SHARP & DOHME (US) 2015-09-02 — — EP disclosed
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