SCHEMBL3523949

SCHEMBL3523949

COCC(=O)N1CCc2cc(Cn3cnc(OCc4ccc(F)cc4F)c(Cl)c3=O)ccc21

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.43
MAPK11 Q15759 2/20 0.43
KMT2A Q03164 1/20 0.39
PTPN11 Q06124 1/20 0.38
DRD2 P14416 2/20 0.38
DRD4 P21917 2/20 0.38
EIF2AK3 Q9NZJ5 1/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
SLC12A2 P55011 1/20 0.36
SLC12A5 Q9H2X9 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3522013 0.92 MAPK14 (0.44) MAPK14MAPK11KMT2ADRD2DRD4
SCHEMBL3523121 0.91 NOTUM (0.46) MAPK14MAPK11MAPTALDH1A1
SCHEMBL3519705 0.90 MAPK14 (0.45) MAPK14MAPK11KMT2ADRD2DRD4
SCHEMBL3522566 0.90 MAPK14 (0.45) MAPK14MAPK11KMT2ADRD2DRD4
SCHEMBL3526735 0.90 MAPK14 (0.42) MAPK14MAPK11KMT2ADRD2DRD4
SCHEMBL3523530 0.89 MAPK14 (0.44) MAPK14MAPK11MAPTALDH1A1
SCHEMBL3519691 0.89 MAPK14 (0.46) MAPK14MAPK11DRD2DRD4MAPT
SCHEMBL3522330 0.88 MAPK14 (0.43) MAPK14MAPK11MAPTALDH1A1
SCHEMBL4385555 0.87 MAPK14 (0.46) MAPK14KMT2APTPN11EIF2AK3MAPT
SCHEMBL3525072 0.87 MAPK14 (0.43) MAPK14MAPK11KMT2APTPN11

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 38/4885MAPK11 43/4885KMT2A 3940/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 MAPK14 29/4885MAPK11 48/4885KMT2A 4243/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPK14 38/4885MAPK11 43/4885KMT2A 3940/4885

“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.