SCHEMBL149441

SCHEMBL149441

CC(C)c1noc(N2CCC(CCCOc3ccc(Br)nc3)CC2)n1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.54
GPR183 P32249 1/20 0.54
KCNH2 Q12809 3/20 0.43
ABCB1 P08183 1/20 0.39
ABCC1 P33527 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
CNR2 P34972 1/20 0.37
ALOX5AP P20292 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 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
SCHEMBL14138942 0.90 GPR119 (0.54) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL387732 0.89 GPR119 (0.66) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL3221208 0.87 GPR119 (0.53) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL145882 0.85 GPR119 (0.49) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL120962 0.85 GPR119 (0.49) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL3209837 0.85 GPR119 (0.53) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL2399035 0.85 GPR119 (0.71) GPR119GPR183KCNH2
SCHEMBL120996 0.85 GPR119 (0.52) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL2892011 0.85 GPR119 (0.53) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL3202075 0.83 GPR119 (0.52) GPR119GPR183KCNH2ABCB1ABCC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120059014-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-08 US disclosed
EP-2406251-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2012-01-18 EP disclosed
WO-2011128394-A1 3-SUBSTITUTED 5-(PYRROLIDINE-1-CARBONYL) PYRROLIDINE AND ITS DERIVATIVES FOR USE IN THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2011-10-20 WO disclosed
WO-2010103334-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 WO disclosed
US-20100048625-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-02-25 US disclosed
US-20100048625-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-02-25 US disclosed
US-20100048625-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-02-25 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 (2 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-20120059014-A1 Compounds for the Treatment of Metabolic Disorders GPR119, FFAR2, GPBAR1 GPR119 1/4885GPR183 48/4885KCNH2 2010/4885
US-20100048625-A1 PIPERIDINE GPCR AGONISTS GPR119, GPR27, GLP1R GPR119 1/4885GPR183 45/4885KCNH2 1128/4885

“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.