SCHEMBL3981387

SCHEMBL3981387

CS(=O)(=O)c1ccc(-c2ccc(CNC3CCN(C(=O)O)CC3)cn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.44
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
PIK3CD O00329 1/20 0.40
JAK3 P52333 1/20 0.40
CTSC P53634 1/20 0.39
ATR Q13535 1/20 0.39
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
GHSR Q92847 1/20 0.39
FABP6 P51161 1/20 0.39
RORC P51449 1/20 0.39
KDM1A O60341 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL4457004 0.88 HSP90AA1 (0.42) GPR119HSP90AA1HSP90AB1PIK3CDJAK3
SCHEMBL3987089 0.87 GPR119 (0.59) GPR119
SCHEMBL3981032 0.85 GPR119 (0.42) GPR119PIK3CDCTSCPIK3CAMTOR
SCHEMBL3983576 0.84 LTA4H (0.40) GPR119MTOR
SCHEMBL3984090 0.83 CXCR4 (0.42) MTORKDM1AMAOA
SCHEMBL3985778 0.83 NPC1 (0.42) GPR119
SCHEMBL4972827 0.82 GPR119 (0.39) GPR119HSP90AA1HSP90AB1PIK3CDJAK3
SCHEMBL3983572 0.82 NPC1 (0.37)
SCHEMBL3988442 0.82 GPR119 (0.44) GPR119PIK3CDJAK3PIK3CAMTOR
SCHEMBL3983393 0.81 PAICS (0.43) GPR119HSP90AA1HSP90AB1PIK3CDJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059516-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (publ) (SE) 2009-05-20 EP claimed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US claimed
WO-2008025798-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO claimed
EP-2059516-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (publ) (SE) 2009-05-20 EP disclosed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
WO-2008025798-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080103123-A1 New compounds GPR119, GPR139, GPR180 GPR119 1/4885HSP90AA1 4101/4885HSP90AB1 3900/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.