SCHEMBL121345

SCHEMBL121345

C[C@H](CCOS(C)(=O)=O)C1CCN(c2ncc(Cl)cn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.46
KCNH2 Q12809 4/20 0.46
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
GRM2 Q14416 1/20 0.35
GRM3 Q14832 1/20 0.35
ACACB O00763 1/20 0.35
SMO Q99835 1/20 0.34

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
SCHEMBL470679 0.80 GPR119 (0.52) GPR119KCNH2HCRTR1HCRTR2NR1H2
SCHEMBL121128 0.80 SIGMAR1 (0.39) GPR119KCNH2HCRTR1HCRTR2ACACB
SCHEMBL148369 0.80 SIGMAR1 (0.39) GPR119KCNH2HCRTR1HCRTR2ACACB
SCHEMBL145832 0.79 GPR119 (0.41) GPR119KCNH2HCRTR1HCRTR2GRM2
SCHEMBL121343 0.79 GPR119 (0.41) GPR119KCNH2HCRTR1HCRTR2GRM2
SCHEMBL20893500 0.78 GPR119 (0.52) GPR119KCNH2KDM4ENPC1RAB9A
SCHEMBL23525307 0.76 GPR119 (0.53) GPR119KCNH2HCRTR1HCRTR2NR1H2
SCHEMBL2891280 0.76 GPR119 (0.44) GPR119KCNH2HCRTR1HCRTR2GRM2
SCHEMBL2891285 0.76 GPR119 (0.44) GPR119KCNH2HCRTR1HCRTR2GRM2
SCHEMBL1295572 0.75 GPR119 (0.39) GPR119KCNH2HCRTR1HCRTR2KDM4E

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
CN-102395578-A Compounds for the treatment of metabolic disorders PROSIDION LTD 2012-03-28 CN disclosed
US-20120059014-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-08 US disclosed
US-20120059014-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-08 US disclosed
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-2010103334-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 WO disclosed
WO-2010103334-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 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-20120059014-A1 Compounds for the Treatment of Metabolic Disorders GPR119, FFAR2, GPBAR1 GPR119 1/4885KCNH2 2010/4885HCRTR1 298/4885

“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.