SCHEMBL3527409

SCHEMBL3527409

Cc1nc(OCc2ccc(F)cc2CNC(=O)Nc2ccccc2)c(Cl)c(=O)n1-c1c(F)cccc1F

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.46
P2RX7 Q99572 2/20 0.43
RAB9A P51151 4/20 0.42
MAPK1 P28482 2/20 0.42
PKM P14618 1/20 0.42
NPC1 O15118 3/20 0.40
MAPK11 Q15759 1/20 0.39
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
MAOB P27338 1/20 0.38
NTRK1 P04629 1/20 0.37
MAPKAPK5 Q8IW41 1/20 0.37

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
SCHEMBL3522356 0.91 MAPK14 (0.51) MAPK14MAPK1MAPK11KMT2AMEN1
SCHEMBL29594809 0.85 MAPK14 (0.66) MAPK14P2RX7RAB9AMAPK1PKM
SCHEMBL4390479 0.85 MAPK14 (0.66) MAPK14P2RX7RAB9AMAPK1PKM
SCHEMBL3524524 0.83 MAPK14 (0.56) MAPK14MAPK1MAPK11MAPKAPK5
SCHEMBL5267652 0.81 MAPK14 (0.54) MAPK14MAPK1MAPKAPK5
SCHEMBL3522967 0.81 MAPK14 (0.67) MAPK14MAPK11
SCHEMBL3519053 0.81 MAPK14 (0.52) MAPK14
SCHEMBL5267142 0.81 MAPK14 (0.50) MAPK14MAPK1MAPK11MAPKAPK5
SCHEMBL5356051 0.81 MAPK14 (0.48) MAPK14MAPK1MAPK11MAPTMAPKAPK5
Trifluoroacetic Acid SCHEMBL3523297 0.81 MAPK14 (0.48) MAPK14MAPK1MAPK11MAPKAPK5

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 38/4885P2RX7 186/4885RAB9A 682/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 MAPK14 29/4885P2RX7 437/4885RAB9A 594/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPK14 38/4885P2RX7 186/4885RAB9A 682/4885

“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.