SCHEMBL2555752

SCHEMBL2555752

CS(=O)(=O)c1ccc(O[C@H]2CC[C@H](OC3CCNCC3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.56
HRH1 P35367 3/20 0.50
SLC9A3 P48764 6/20 0.44
HRH3 Q9Y5N1 2/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTGS2 P35354 1/20 0.42
GCK P35557 1/20 0.40
ROCK2 O75116 1/20 0.40
PRKACA P17612 1/20 0.40
PRKCD Q05655 1/20 0.40
ROCK1 Q13464 1/20 0.40
PRKG1 Q13976 1/20 0.40
PKN1 Q16512 1/20 0.40
PKN2 Q16513 1/20 0.40
AAK1 Q2M2I8 1/20 0.40
CDC42BPA Q5VT25 1/20 0.40
Q6ZSR9 Q6ZSR9 1/20 0.40
BMP2K Q9NSY1 1/20 0.40
CDC42BPB Q9Y5S2 1/20 0.40

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
SCHEMBL2555749 1.00 GPR119 (0.56) GPR119HRH1SLC9A3HRH3MAPT
Hydrochloric Acid SCHEMBL14634228 0.99 GPR119 (0.55) GPR119HRH1SLC9A3HRH3MAPT
Hydrochloric Acid SCHEMBL2553809 0.99 GPR119 (0.55) GPR119HRH1SLC9A3HRH3MAPT
SCHEMBL4717235 0.94 HRH1 (0.56) GPR119HRH1SLC9A3HRH3MAPT
Hydrochloric Acid SCHEMBL4105228 0.92 HRH1 (0.54) GPR119HRH1SLC9A3HRH3MAPT
SCHEMBL4723865 0.81 HRH3 (0.56) GPR119HRH1SLC9A3HRH3MAPT
SCHEMBL27669120 0.79 PTGS2 (0.52) GPR119HRH1HRH3MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL2557741 0.79 GPR119 (0.59) GPR119PTGS2
Hydrochloric Acid SCHEMBL14634431 0.79 GPR119 (0.59) GPR119PTGS2
SCHEMBL28714688 0.78 GPR119 (0.51) GPR119HRH1SLC9A3HRH3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2556056-A1 MODULATORS OF THE GPR119 RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2013-02-13 EP disclosed
US-20130023494-A1 MODULATORS OF THE GPR119 RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2013-01-24 US disclosed
WO-2011127051-A1 MODULATORS OF THE GPR119 RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2011-10-13 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-20130023494-A1 MODULATORS OF THE GPR119 RECEPTOR AND THE TREATMENT OF DISORDERS RELATED THERETO GPR119, SLC5A2, SLC5A1 GPR119 1/4885HRH1 2397/4885SLC9A3 267/4885

“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.