SCHEMBL7998454

SCHEMBL7998454

Bc1ccc(C(F)(F)F)cc1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 12/20 0.49
▸ F13A1 P00488 9/20 0.49
▸ TGM1 P22735 6/20 0.49
▸ MAPT P10636 1/20 0.49
▸ GPR119 Q8TDV5 2/20 0.48
▸ TGM3 Q08188 1/20 0.48
▸ STS P08842 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ TGFBR1 P36897 1/20 0.44
▸ P2RY14 Q15391 1/20 0.44

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
SCHEMBL308426 0.87 TGM2 (0.53) TGM2F13A1TGM1MAPTGPR119
SCHEMBL309691 0.86 EPHX2 (0.55) TGM2F13A1TGM1MAPTGPR119
SCHEMBL309243 0.82 TGM2 (0.64) TGM2F13A1TGM1MAPTGPR119
SCHEMBL2312877 0.81 LMNA (0.62) TGM2F13A1TGM1STSTGFBR1
SCHEMBL13076730 0.79 GPR119 (0.53) MAPTGPR119STSMEN1ALDH1A1
SCHEMBL5442261 0.75 TGM2 (0.52) TGM2F13A1TGM1GPR119TGM3
SCHEMBL31142873 0.75 GPR119 (0.69) MAPTGPR119STSMEN1ALDH1A1
SCHEMBL3922455 0.75 GPR119 (0.69) MAPTGPR119STSMEN1ALDH1A1
SCHEMBL29060791 0.74 TGM2 (0.64) TGM2F13A1TGM1
SCHEMBL13261277 0.74 GPR119 (0.59) MAPTGPR119MEN1ALDH1A1KMT2A

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
WO-2010007074-A1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2010-01-21 — — WO disclosed
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