SCHEMBL4456659

SCHEMBL4456659

NC(=O)c1ccc(-c2cnc(OCC3CCN(C(=O)O)CC3)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 4/20 0.48
PARP10 Q53GL7 4/20 0.48
PARP2 Q9UGN5 2/20 0.48
CHEK2 O96017 4/20 0.44
MAP4K4 O95819 2/20 0.44
AOC3 Q16853 4/20 0.43
ACHE P22303 1/20 0.42
MKNK1 Q9BUB5 2/20 0.41
MKNK2 Q9HBH9 2/20 0.41
GRIN2B Q13224 1/20 0.40
GPR119 Q8TDV5 1/20 0.39

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
SCHEMBL4461819 0.86 CHRM4 (0.43) MAP4K4AOC3ACHEGRIN2BGPR119
SCHEMBL4455478 0.85 GPR119 (0.46) MAP4K4AOC3ACHEGRIN2BGPR119
SCHEMBL14191521 0.85 CHEK2 (0.58) CHEK2GPR119
SCHEMBL4455518 0.85 GRIN2B (0.46) MAP4K4AOC3ACHEGRIN2BGPR119
SCHEMBL4452034 0.84 CA2 (0.44) MAP4K4AOC3ACHEGRIN2BGPR119
SCHEMBL4455454 0.84 GPR119 (0.46) GPR119
SCHEMBL4457038 0.84 POLB (0.51) CHEK2MKNK1MKNK2
SCHEMBL4457549 0.84 HRH3 (0.47) MKNK1MKNK2
SCHEMBL4461701 0.84 HDAC4 (0.44) CHEK2ACHE
SCHEMBL4455486 0.83 PARP10 (0.49) PARP15PARP10CHEK2AOC3ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059517-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS Biovitrum AB (publ) (SE) 2009-05-20 EP claimed
US-20080103141-A1 New compounds BIOVITRUM (SE) 2008-05-01 US claimed
WO-2008025800-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO claimed
EP-2059517-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS Biovitrum AB (publ) (SE) 2009-05-20 EP disclosed
US-20080103141-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
WO-2008025800-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 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-20080103141-A1 New compounds GPR119, GPR3, GPR4 PARP15 3609/4885PARP10 3610/4885PARP2 4504/4885

“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.