SCHEMBL1550872

SCHEMBL1550872

CC(C)(C)OC(=O)N1CCC(Oc2cc(=O)n(-c3ccc(Cl)c(Cl)c3)nc2C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 1/20 0.50
▸ MCHR1 Q99705 1/20 0.50
▸ TOP2A P11388 1/20 0.45
▸ GPR119 Q8TDV5 8/20 0.45
▸ CACNB4 O00305 2/20 0.44
▸ CACNA1A O00555 2/20 0.44
▸ CACNA1G O43497 2/20 0.44
▸ CACNG3 O60359 2/20 0.44
▸ CACNA1F O60840 2/20 0.44
▸ CACNA1H O95180 2/20 0.44
▸ CACNB3 P54284 2/20 0.44
▸ CACNA2D1 P54289 2/20 0.44
▸ CACNG7 P62955 2/20 0.44
▸ CACNA1B Q00975 2/20 0.44
▸ CACNA1D Q01668 2/20 0.44
▸ CACNB1 Q02641 2/20 0.44
▸ CACNG1 Q06432 2/20 0.44
▸ CACNB2 Q08289 2/20 0.44
▸ CACNA1S Q13698 2/20 0.44
▸ CACNA1C Q13936 2/20 0.44

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
SCHEMBL2546305 0.92 NPBWR1 (0.49) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL2543445 0.91 NPBWR1 (0.51) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL2544290 0.91 NPBWR1 (0.48) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL2547617 0.90 NPBWR1 (0.52) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL2542457 0.88 NPBWR1 (0.51) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL2542448 0.87 NPBWR1 (0.51) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL2541771 0.86 NPBWR1 (0.49) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL14237487 0.85 GPR119 (0.45) NPBWR1MCHR1TOP2AGPR119CACNB4
SCHEMBL14237663 0.85 GPR119 (0.61) GPR119
SCHEMBL14237483 0.83 GPR119 (0.49) NPBWR1MCHR1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2313395-B1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2012-12-19 — — EP claimed
US-20130131074-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2013-05-23 — — US disclosed
US-8372837-B2 Pyridone and pyridazone analogues as GPR119 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2013-02-12 — — US disclosed
EP-2313395-B1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2012-12-19 — — EP disclosed
US-20110263548-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-27 — — US disclosed
EP-2313395-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS Bristol-Myers Squibb Company (US) 2011-04-27 — — EP disclosed
WO-2010009183-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-01-21 — — 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 (2 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-20130131074-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS GPR119, GPR4, GPR3 NPBWR1 200/4885MCHR1 290/4885TOP2A 4446/4885
US-20110263548-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS GPR119, GPR4, GPR3 NPBWR1 209/4885MCHR1 306/4885TOP2A 4474/4885

“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.

Send feedback