SCHEMBL5269264

SCHEMBL5269264

O=c1c(Cl)c(OCc2ccc(F)cc2F)ncn1-c1c(F)cc(CNCC2CC2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.49
MAPK11 Q15759 3/20 0.49
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
SLC6A4 P31645 1/20 0.39
PREP P48147 1/20 0.35

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
Hydrochloric Acid SCHEMBL3525078 0.99 MAPK14 (0.49) MAPK14MAPK11HTR2AHTR2CSLC6A4
SCHEMBL5265660 0.85 MAPK14 (0.53) MAPK14MAPK11HTR2AHTR2CSLC6A4
SCHEMBL13602920 0.85 MAPK14 (0.45) MAPK14PREP
Hydrochloric Acid SCHEMBL3518780 0.84 MAPK14 (0.53) MAPK14MAPK11HTR2AHTR2CSLC6A4
Hydrochloric Acid SCHEMBL4377579 0.84 MAPK14 (0.44) MAPK14PREP
SCHEMBL3522398 0.84 MAPK14 (0.58) MAPK14MAPK11
SCHEMBL3526927 0.84 MAPK14 (0.57) MAPK14MAPK11
SCHEMBL5270020 0.82 MAPK14 (0.53) MAPK14MAPK11
SCHEMBL3527712 0.82 MAPK14 (0.53) MAPK14MAPK11
SCHEMBL3524386 0.81 MAPK14 (0.48) MAPK14MAPK11HTR2AHTR2C

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753731-A2 PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS Pharmacia Corporation (US) 2007-02-21 EP disclosed
WO-2004087677-A2 PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS PHARMACIA CORPORATION (US) 2004-10-14 WO disclosed