SCHEMBL3979438

SCHEMBL3979438

CN(CC1CCN(C(=O)O)CC1)c1ccc(-c2ccc(S(C)(=O)=O)cc2)cn1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.44
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
USP30 Q70CQ3 1/20 0.38
MCHR1 Q99705 1/20 0.38
GAA P10253 2/20 0.37
MELK Q14680 1/20 0.37
LIMK2 P53671 1/20 0.37
MAPK1 P28482 1/20 0.37
MAP4K4 O95819 1/20 0.36
MINK1 Q8N4C8 1/20 0.36
TNIK Q9UKE5 1/20 0.36

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
SCHEMBL14190964 0.86 GPR119 (0.60) GPR119
SCHEMBL3981756 0.79 GPR119 (0.42) GPR119MCHR1MAP4K4MINK1TNIK
SCHEMBL3986213 0.79 PTGS1 (0.43) GPR119
SCHEMBL3978507 0.78 USP30 (0.47) GPR119CKS1BSKP1SKP2USP30
SCHEMBL4457000 0.78 PTGS2 (0.44) GPR119CKS1BSKP1SKP2
SCHEMBL4452073 0.77 VCP (0.49) GPR119CKS1BSKP1SKP2
SCHEMBL3983250 0.76 GPR119 (0.41) GPR119
SCHEMBL3983393 0.76 PAICS (0.43) GPR119CKS1BSKP1SKP2MCHR1
SCHEMBL27734780 0.73 GPR119 (0.45) GPR119
SCHEMBL27662244 0.73 GPR119 (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US 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 1/4885CKS1B 2287/4885SKP1 3585/4885

“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.