SCHEMBL3522703

SCHEMBL3522703

O=C(O)c1ccc(-n2cnc(OCc3ccccc3)c(Br)c2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.48
NR4A2 P43354 1/20 0.48
NR4A3 Q92570 1/20 0.48
SRD5A2 P31213 2/20 0.45
PLA2G4B P0C869 1/20 0.43
POLB P06746 1/20 0.43
RXRA P19793 4/20 0.42
RXRB P28702 3/20 0.42
MAPK14 Q16539 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RXRG P48443 1/20 0.40
HPGD P15428 1/20 0.40
GAA P10253 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
SCHEMBL3522454 0.91 PARP10 (0.50) MAPK14GAA
SCHEMBL3520099 0.90 HDAC6 (0.45)
SCHEMBL3524455 0.89 FGFR1 (0.50) POLBMEN1KMT2AHPGD
SCHEMBL3526646 0.84 MAOB (0.43) MAPK14MEN1KMT2AHPGD
SCHEMBL5267895 0.83 SIGMAR1 (0.45) MEN1KMT2AHPGD
SCHEMBL3525381 0.83 ALDH1A1 (0.51) MEN1KMT2AHPGDGAA
Hydrochloric Acid SCHEMBL3521848 0.83 SIGMAR1 (0.44) MEN1KMT2AHPGD
SCHEMBL3521536 0.82 MAPT (0.39) POLBMAPK14MEN1KMT2A
SCHEMBL3522032 0.82 MAOB (0.48) MAPK14
SCHEMBL3520672 0.82 MAPK14 (0.51) NR4A1NR4A2NR4A3SRD5A2RXRA

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 NR4A1 2532/4885NR4A2 2750/4885NR4A3 3220/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 NR4A1 2568/4885NR4A2 3054/4885NR4A3 3532/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 NR4A1 2532/4885NR4A2 2750/4885NR4A3 3220/4885

“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.