SCHEMBL4508520

SCHEMBL4508520

CC(C)(C)OC(=O)NCc1cc(F)ccc1CBr

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.43
KDM4A O75164 1/20 0.42
KCNA5 P22460 1/20 0.41
GRM2 Q14416 1/20 0.41
AAK1 Q2M2I8 4/20 0.39
RPS6KA1 Q15418 1/20 0.39
EPAS1 Q99814 1/20 0.38
CTSS P25774 2/20 0.38
CTSK P43235 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
BRD4 O60885 1/20 0.37
IDO1 P14902 1/20 0.37

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
SCHEMBL12791296 0.87 P2RX7 (0.46) KDM4AKCNA5GRM2RPS6KA1
SCHEMBL27669311 0.85 GRM2 (0.47) GPR119KDM4AKCNA5GRM2RPS6KA1
SCHEMBL23105713 0.85 KDM4A (0.43) GPR119KDM4AKCNA5GRM2AAK1
SCHEMBL23105674 0.85 P2RX7 (0.48) KDM4AKCNA5GRM2AAK1RPS6KA1
SCHEMBL29555276 0.85 KDM4A (0.43) GPR119KDM4AKCNA5GRM2AAK1
SCHEMBL1654680 0.85 KDM4A (0.45) KDM4AKCNA5GRM2RPS6KA1CTSS
SCHEMBL27669478 0.84 GRM2 (0.43) GPR119KDM4AKCNA5GRM2RPS6KA1
SCHEMBL23735207 0.83 EGFR (0.44) GPR119KDM4AKCNA5GRM2RPS6KA1
SCHEMBL11933658 0.83 P2RX7 (0.48) KDM4AKCNA5GRM2RPS6KA1CTSS
SCHEMBL30487345 0.83 KDM4A (0.41) GPR119KDM4AKCNA5GRM2RPS6KA1

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
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
EP-1987022-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES Pfizer Products Inc. (US) 2008-11-05 EP disclosed
WO-2007091176-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-08-16 WO disclosed
WO-2007091176-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-08-16 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-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PDXK, UMPS, CDK2 GPR119 1642/4885KDM4A 1897/4885KCNA5 3397/4885

“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.