SCHEMBL2546271

SCHEMBL2546271

CC(C)(C)OC(=O)N1CCC(Oc2cc(=O)n(-c3ccc(C#N)nc3)nc2C(N)=O)CC1.CC(C)(C)OC(=O)N1CCC(Oc2cc(=O)n(-c3ccc(C#N)nc3)nc2C(N)=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 12/20 0.51
▸ NPBWR1 P48145 1/20 0.42
▸ MCHR1 Q99705 1/20 0.42
▸ JAK2 O60674 1/20 0.42
▸ JAK1 P23458 1/20 0.42
▸ TBK1 Q9UHD2 2/20 0.41
▸ CHEK2 O96017 1/20 0.41
▸ KDM1A O60341 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ ALK Q9UM73 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
SCHEMBL1551215 1.00 GPR119 (0.51) GPR119NPBWR1MCHR1JAK2JAK1
SCHEMBL14237467 0.93 GPR119 (0.51) GPR119NPBWR1MCHR1TBK1PDE4B
SCHEMBL2542770 0.91 GPR119 (0.50) GPR119NPBWR1MCHR1TBK1PDE4B
SCHEMBL2544042 0.89 GPR119 (0.53) GPR119NPBWR1MCHR1TBK1PDE4B
SCHEMBL14237660 0.88 JAK3 (0.36) GPR119KDM1APDE4B
SCHEMBL2542239 0.85 GPR119 (0.48) GPR119NPBWR1MCHR1JAK2JAK1
SCHEMBL2546305 0.82 NPBWR1 (0.49) GPR119NPBWR1MCHR1CHEK2KDM1A
SCHEMBL2545267 0.82 GPR119 (0.60) GPR119
SCHEMBL2540793 0.81 ALDH1A1 (0.50) GPR119NPBWR1MCHR1CHEK2KDM1A
SCHEMBL2540906 0.80 GPR119 (0.45) GPR119NPBWR1MCHR1CHEK2KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263548-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-27 — — US 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-20110263548-A1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS GPR119, GPR4, GPR3 GPR119 1/4885NPBWR1 209/4885MCHR1 306/4885

“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.

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