SCHEMBL3980484

SCHEMBL3980484

CN(C)C(=O)c1ccc(-c2ccc(CN(C)C3CCN(C(=O)O)CC3)cn2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.45
MCHR1 Q99705 7/20 0.44
KCNH2 Q12809 4/20 0.44
HTR2C P28335 3/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TP53 P04637 1/20 0.41
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
CYP2D6 P10635 2/20 0.39
HTR5A P47898 1/20 0.39
DAGLA Q9Y4D2 1/20 0.39

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
SCHEMBL3983148 0.91 GPR119 (0.47) GPR119MCHR1KCNH2HTR2CNPC1
SCHEMBL14190997 0.88 GPR119 (0.47) GPR119MCHR1KCNH2HTR2CNPC1
SCHEMBL14285890 0.87 GPR119 (0.63) GPR119
SCHEMBL4050800 0.86 ALDH1A1 (0.41) GPR119MCHR1SMN1; SMN2TP53
SCHEMBL3978505 0.85 HRH3 (0.45) NPC1RAB9ASMN1; SMN2
SCHEMBL3978787 0.85 MKNK1 (0.48) GPR119MCHR1NPC1RAB9ASMN1; SMN2
SCHEMBL3984054 0.85 GPR119 (0.48) GPR119KCNH2
SCHEMBL3981182 0.84 GPR119 (0.42) GPR119MCHR1KCNH2HTR2CNPC1
SCHEMBL3985778 0.83 NPC1 (0.42) GPR119MCHR1KCNH2HTR2CNPC1
SCHEMBL3981515 0.78 GPR119 (0.57) 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 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 1/4885MCHR1 108/4885KCNH2 1859/4885

“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.