SCHEMBL3523121

SCHEMBL3523121

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

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
MAPK14 Q16539 9/20 0.45
MAPK11 Q15759 2/20 0.45
LMNA P02545 4/20 0.43
POLB P06746 2/20 0.42
CYP11B2 P19099 2/20 0.38
CYP11B1 P15538 1/20 0.38

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
SCHEMBL3523530 0.92 MAPK14 (0.44) NOTUMALDH1A1MAPTMAPK14MAPK11
SCHEMBL3519691 0.92 MAPK14 (0.46) NOTUMALDH1A1MAPTMAPK14MAPK11
SCHEMBL3522013 0.91 MAPK14 (0.44) ALDH1A1MAPTMAPK14MAPK11
SCHEMBL3522330 0.91 MAPK14 (0.43) NOTUMALDH1A1MAPTMAPK14MAPK11
SCHEMBL3523949 0.91 MAPK14 (0.43) ALDH1A1MAPTMAPK14MAPK11
SCHEMBL3519705 0.90 MAPK14 (0.45) ALDH1A1MAPTMAPK14MAPK11LMNA
SCHEMBL3522566 0.90 MAPK14 (0.45) ALDH1A1MAPTMAPK14MAPK11
SCHEMBL3526735 0.89 MAPK14 (0.42) ALDH1A1MAPTMAPK14MAPK11
SCHEMBL3525955 0.88 MAPK14 (0.47) MAPK14MAPK11
SCHEMBL3523055 0.86 MAPK14 (0.44) MAPK14MAPK11

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 NOTUM 4139/4885ALDH1A1 874/4885MAPT 2576/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 NOTUM 3806/4885ALDH1A1 550/4885MAPT 3038/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 NOTUM 4139/4885ALDH1A1 874/4885MAPT 2576/4885

“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.