SCHEMBL8535622

SCHEMBL8535622

COc1cnc2c(ccn2-c2ccc(OC3CCN(C(=O)OC(C)(C)C)CC3)cn2)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.47
ALDH1A1 P00352 1/20 0.44
CHEK2 O96017 1/20 0.44
HTT P42858 1/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
HRH3 Q9Y5N1 3/20 0.42
PIK3CD O00329 1/20 0.42
STS P08842 1/20 0.41

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
SCHEMBL9266408 0.89 GPR119 (0.47) GPR119ALDH1A1CHEK2HTTPDE4A
SCHEMBL15253534 0.88 GPR119 (0.56) GPR119
SCHEMBL8532708 0.81 CHEK2 (0.45) GPR119ALDH1A1CHEK2PDE4APDE4B
SCHEMBL8530128 0.81 CHEK2 (0.46) GPR119CHEK2PDE4APDE4BPDE4C
SCHEMBL8535619 0.80 HRH3 (0.35) GPR119HRH3
SCHEMBL8534642 0.80 GPR119 (0.45) GPR119CHEK2
SCHEMBL9250289 0.79 GPR119 (0.59) GPR119
SCHEMBL8536669 0.79 GPR119 (0.48) GPR119CHEK2HRH3PIK3CD
SCHEMBL15253090 0.79 GPR119 (0.58) GPR119CHEK2
SCHEMBL15253238 0.79 CHEK2 (0.44) GPR119CHEK2PDE4APDE4BPDE4C

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 1/4885ALDH1A1 1436/4885CHEK2 3915/4885

“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.