SCHEMBL5083497

SCHEMBL5083497

C[C@H]1CN(C(=O)O)CC[C@@H]1N(C)Cc1ccc(-c2ccc(S(C)(=O)=O)cc2)nc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.43
RORC P51449 1/20 0.37
KCNH2 Q12809 2/20 0.36
PIK3CA P42336 1/20 0.36
MTOR P42345 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
SCHEMBL5079844 1.00 GPR119 (0.43) GPR119RORCKCNH2PIK3CAMTOR
SCHEMBL3986020 1.00 GPR119 (0.43) GPR119RORCKCNH2PIK3CAMTOR
SCHEMBL14191007 0.89 GPR119 (0.55) GPR119
SCHEMBL14218038 0.89 GPR119 (0.55) GPR119
SCHEMBL14191008 0.89 GPR119 (0.55) GPR119
SCHEMBL3984054 0.86 GPR119 (0.48) GPR119RORCKCNH2PIK3CAMTOR
SCHEMBL3980543 0.82 F2R (0.40) GPR119
SCHEMBL3981032 0.81 GPR119 (0.42) GPR119PIK3CAMTOR
SCHEMBL3980193 0.80 GPR119 (0.50) GPR119RORCKCNH2PIK3CAMTOR
SCHEMBL3983937 0.79 GPR119 (0.47) GPR119RORCKCNH2PIK3CAMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US claimed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US 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 1/4885RORC 154/4885KCNH2 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.