SCHEMBL3523796

SCHEMBL3523796

Cc1c(OCc2ccc(F)cc2)ncn(Cc2cccc(F)c2)c1=O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.55
MAPT P10636 8/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
ALDH1A1 P00352 1/20 0.52
THRB P10828 1/20 0.48
HPGD P15428 3/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 4/20 0.46
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 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
SCHEMBL3520910 0.94 MAPK14 (0.53) MAPK14MAPTSMN1; SMN2ALDH1A1THRB
SCHEMBL3520984 0.88 MAPK14 (0.58) MAPK14MAPTSMN1; SMN2ALDH1A1THRB
SCHEMBL3524659 0.86 MAPK14 (0.55) MAPK14MAPTSMN1; SMN2ALDH1A1THRB
SCHEMBL3521534 0.86 MAPK14 (0.67) MAPK14MAPTSMN1; SMN2ALDH1A1THRB
SCHEMBL3521895 0.81 MAPK14 (0.60) MAPK14SMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL3519707 0.81 MAPK14 (0.59) MAPK14MAPTSMN1; SMN2ALDH1A1THRB
SCHEMBL3525443 0.81 MAPK14 (0.53) MAPK14MAPTSMN1; SMN2ALDH1A1THRB
SCHEMBL4376402 0.81 MAPK14 (0.76) MAPK14MAPTSMN1; SMN2ALDH1A1
SCHEMBL3521113 0.80 MAPK14 (0.58) MAPK14MAPTSMN1; SMN2ALDH1A1THRB
SCHEMBL3523536 0.80 MAPK14 (0.56) MAPK14MAPTSMN1; SMN2ALDH1A1THRB

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 MAPK14 38/4885MAPT 2576/4885SMN1; SMN2 912/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 MAPK14 29/4885MAPT 3038/4885SMN1; SMN2 746/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPK14 38/4885MAPT 2576/4885SMN1; SMN2 912/4885

“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.