SCHEMBL8530737

SCHEMBL8530737

CC(C)(C)OC(=O)N1CCC(Oc2ccc(-n3ccc4cc(C(=O)NCCO)ccc43)nc2)C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.41
CHEK2 O96017 2/20 0.39
GPR119 Q8TDV5 1/20 0.39
CHRNA7 P36544 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
USP30 Q70CQ3 1/20 0.38

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
SCHEMBL15253109 0.95 CHEK2 (0.42) CHEK2GPR119L3MBTL1
SCHEMBL8537358 0.89 ROCK1 (0.41) CHRNA7L3MBTL1
SCHEMBL15253286 0.88 GPR119 (0.49) PIK3CDCHEK2GPR119L3MBTL1
SCHEMBL15253243 0.86 GPR119 (0.42) GPR119CHRNA7L3MBTL1
SCHEMBL8533555 0.86 ROCK1 (0.42) GPR119CHRNA7L3MBTL1
SCHEMBL8535761 0.86 PIK3CD (0.43) PIK3CDCHEK2GPR119L3MBTL1
SCHEMBL9258674 0.86 HPGDS (0.45) CHEK2GPR119USP30
SCHEMBL15253238 0.85 CHEK2 (0.44) CHEK2GPR119
SCHEMBL8535909 0.85 GPR119 (0.52) GPR119L3MBTL1
SCHEMBL8537789 0.84 CHEK2 (0.43) CHEK2GPR119

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 PIK3CD 2657/4885CHEK2 3915/4885GPR119 1/4885

“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.