SCHEMBL3524830

SCHEMBL3524830

COc1cc(Nc2ncn(Cc3cccc(F)c3)c(=O)c2Br)cc(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.47
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
P2RX7 Q99572 7/20 0.43
GRIN1 Q05586 3/20 0.43
GRIN2B Q13224 3/20 0.43
BRAF P15056 1/20 0.43
PDGFRB P09619 1/20 0.42
KDR P35968 1/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
PTGER3 P43115 1/20 0.42
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL3522187 0.83 MAPK14 (0.48) MAPK14KDM4EHPGDNPSR1LMNA
SCHEMBL4487174 0.83 MAPK14 (0.54) MAPK14KDM4EP2RX7BRAFPDGFRB
SCHEMBL3520013 0.82 MAPT (0.53) MAPK14KDM4EHPGDNPSR1LMNA
SCHEMBL3523270 0.78 MAPK14 (0.49) MAPK14KDM4EHPGDNPSR1PDGFRB
SCHEMBL3521065 0.77 MAPK14 (0.52) MAPK14KDM4EHPGDNPSR1LMNA
SCHEMBL3524048 0.76 KDM4E (0.48) MAPK14KDM4EHPGDNPSR1LMNA
SCHEMBL3521808 0.73 MAPK14 (0.44) MAPK14KDM4EHPGDNPSR1LMNA
SCHEMBL3521076 0.73 MAPT (0.49) MAPK14KDM4EHPGDNPSR1LMNA
SCHEMBL3526877 0.73 HPGD (0.57) MAPK14KDM4EHPGDNPSR1MAPT
SCHEMBL3523859 0.73 MAPK14 (0.57) MAPK14KDM4EHPGDNPSR1LMNA

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 5 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
US-20040242608-A1 Substituted pyrimidinones PHARMACIA LLC 2004-12-02 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 (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 MAPK14 38/4885KDM4E 3806/4885HPGD 418/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 MAPK14 29/4885KDM4E 3935/4885HPGD 442/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPK14 38/4885KDM4E 3806/4885HPGD 418/4885

“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.