SCHEMBL8512802

SCHEMBL8512802

CS(=O)(=O)c1ccc2c(c1)CCN2c1ccc(NC2CCN(C(=O)O)CC2)cn1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.57
ROCK1 Q13464 1/20 0.48
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRB3 P13945 1/20 0.46

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
SCHEMBL8511165 0.88 GPR119 (0.75) GPR119
SCHEMBL515793 0.84 GPR119 (0.78) GPR119ROCK1
SCHEMBL8510291 0.82 GPR119 (0.64) GPR119ROCK1ADRB2ADRB1ADRB3
SCHEMBL15253239 0.78 CDK2 (0.39) GPR119
SCHEMBL2718671 0.75 GPR119 (0.56) GPR119ROCK1
SCHEMBL299959 0.74 GPR119 (0.80) GPR119
SCHEMBL514317 0.73 GPR119 (1.00) GPR119
SCHEMBL1065989 0.73 GPR119 (0.79) GPR119
SCHEMBL8512911 0.71 GPR119 (0.64) GPR119
SCHEMBL8512909 0.71 GPR119 (0.50) GPR119ROCK1

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-9000175-B2 Bicyclic GPR119 modulators LUPIN LIMITED (IN) 2015-04-07 US disclosed
EP-2643311-A1 BICYCLIC GPR119 MODULATORS Lupin Limited (IN) 2013-10-02 EP disclosed
US-20130245000-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2013-09-19 US disclosed
WO-2012069917-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2012-05-31 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-20130245000-A1 BICYCLIC GPR119 MODULATORS GPR119, GPR180, GPBAR1 GPR119 1/4885ROCK1 2378/4885ADRB2 65/4885

“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.