SCHEMBL3526294

SCHEMBL3526294

CC(C)(C)OC(=O)N1CCC(Cn2cnc(OCc3ccccc3)c(Br)c2=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 4/20 0.51
YAP1 P46937 3/20 0.48
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
PRMT5 O14744 3/20 0.45
STS P08842 1/20 0.43
GPR119 Q8TDV5 2/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FPR2 P25090 1/20 0.42
BACE1 P56817 1/20 0.42

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
SCHEMBL3525505 0.90 USP7 (0.47) USP7YAP1PRMT5
SCHEMBL27683018 0.88 BTK (0.41) USP7SMN1; SMN2
SCHEMBL3523774 0.85 HCAR1 (0.47) YAP1KDM4EPKMPRMT5STS
SCHEMBL4482872 0.84 MAPK14 (0.52) USP7YAP1KDM4EPKMPRMT5
SCHEMBL27683064 0.79 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL29116026 0.77 GPR119 (0.52) USP7YAP1KDM4EPKMGPR119
SCHEMBL24542521 0.75 USP7 (0.49) USP7KDM4EPKMGPR119FPR2
SCHEMBL4768843 0.74 KDM4E (0.51) USP7KDM4EPKMGPR119BACE1
SCHEMBL23531623 0.74 USP7 (0.46) USP7KDM4EPKMGPR119FPR2
SCHEMBL23531642 0.74 USP7 (0.51) USP7KDM4EPKMSTSGPR119

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
US-7795271-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2010-09-14 US disclosed
US-20090306108-A1 SUBSTITUTED PYRIMIDINONES PFIZER INC 2009-12-10 US disclosed
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES PHARMACIA CORPORATION (US) 2007-07-19 US disclosed
US-7183287-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2007-02-27 US disclosed
EP-1753731-A2 PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS Pharmacia Corporation (US) 2007-02-21 EP disclosed
US-20040242608-A1 Substituted pyrimidinones PHARMACIA LLC 2004-12-02 US disclosed
WO-2004087677-A2 PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS PHARMACIA CORPORATION (US) 2004-10-14 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 (3 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-20090306108-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 USP7 3270/4885YAP1 2778/4885KDM4E 3806/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 USP7 3409/4885YAP1 3518/4885KDM4E 3935/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 USP7 3270/4885YAP1 2778/4885KDM4E 3806/4885

“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.