SCHEMBL17965092

SCHEMBL17965092

CS(=O)(=O)c1ccc(-c2nc3cc(C4=CCN(C(=O)O)CC4)ccc3o2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 4/20 0.41
▸ DPP4 P27487 1/20 0.38
▸ DPP7 Q9UHL4 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ GPR119 Q8TDV5 4/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ S1PR1 P21453 2/20 0.37
▸ S1PR3 Q99500 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ SLC6A9 P48067 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ QDPR P09417 1/20 0.35
▸ HPSE Q9Y251 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35

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
SCHEMBL14158855 0.89 GPR119 (0.50) GPR119
SCHEMBL14695343 0.83 MMP2 (0.44) HDAC6PTGS2GPR119MMP2MMP3
SCHEMBL14695968 0.82 GPR119 (0.50) GPR119
SCHEMBL14695345 0.82 MMP2 (0.44) HDAC6GPR119MMP2MMP3HDAC3
SCHEMBL17965159 0.82 LIPC (0.42) DPP4DPP7GPR119MMP2MMP3
SCHEMBL17965046 0.79 S1PR1 (0.43) HDAC6DPP4DPP7GPR119S1PR1
SCHEMBL17993970 0.79 PTGS2 (0.41) HDAC6PTGS2HDAC3HDAC8MAPT
Trifluoroacetic Acid SCHEMBL14158710 0.79 TBK1 (0.40) HDAC6DPP4DPP7PTGS2GPR119
SCHEMBL17965205 0.78 GPR119 (0.46) HDAC6DPP4DPP7GPR119S1PR1
SCHEMBL14695393 0.77 GPR119 (0.48) GPR119

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-2718279-B1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 RHIZEN PHARMACEUTICALS SA (CH) 2016-08-10 — — EP claimed
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