SCHEMBL2215285

SCHEMBL2215285

C[C@H](CCOc1ccc(S(C)(=O)=O)cc1)C1CCN(c2noc(CN3CCOCC3)n2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.39
GPR183 P32249 1/20 0.39
ACACB O00763 2/20 0.39
POLB P06746 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
HRH3 Q9Y5N1 2/20 0.37
JAK2 O60674 1/20 0.37
JAK3 P52333 1/20 0.37
PTK2 Q05397 1/20 0.37
CYP3A4 P08684 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ACACA Q13085 1/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 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
SCHEMBL2216969 0.93 GPR119 (0.40) GPR119GPR183ACACBHRH3JAK2
SCHEMBL2214982 0.85 GPR119 (0.41) GPR119GPR183ACACBACACA
SCHEMBL2215227 0.85 GPR119 (0.40) GPR119GPR183CYP3A4
SCHEMBL2370710 0.83 GPR119 (0.45) GPR119GPR183
SCHEMBL2218508 0.82 GPR119 (0.39) GPR119GPR183CYP3A4
SCHEMBL1295590 0.80 GPR119 (0.55) GPR119HRH3SMN1; SMN2MEN1KMT2A
SCHEMBL2216225 0.78 GPR119 (0.39) GPR119GPR183CYP3A4SMN1; SMN2RAB9A
SCHEMBL2216220 0.78 GPR119 (0.39) GPR119GPR183CYP3A4SMN1; SMN2RAB9A
SCHEMBL2214804 0.78 GPR119 (0.47) GPR119GPR183HRH3JAK2JAK3
SCHEMBL2218892 0.78 GPR119 (0.39) GPR119GPR183CYP3A4MEN1

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-20110178054-A1 Heterocyclic GPCR Agonists PROSIDION LIMITED (GB) 2011-07-21 US disclosed
US-20110178054-A1 Heterocyclic GPCR Agonists PROSIDION LIMITED (GB) 2011-07-21 US disclosed
US-20110178054-A1 Heterocyclic GPCR Agonists PROSIDION LIMITED (GB) 2011-07-21 US disclosed
WO-2010004348-A1 HETEROCYCLIC GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-14 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-20110178054-A1 Heterocyclic GPCR Agonists GPR119, GCGR, GPR27 GPR119 1/4885GPR183 27/4885ACACB 2654/4885

“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.