SCHEMBL13635848

SCHEMBL13635848

Cc1c(OCc2ccccc2)ccn(Cc2ccccc2C(F)(F)F)c1=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.70
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
P2RX7 Q99572 1/20 0.43
MAPK1 P28482 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ATM Q13315 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
POLB P06746 1/20 0.40

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
SCHEMBL4390002 0.86 MAPK14 (0.70) MAPK14FFAR1FFAR4P2RX7MAPK1
SCHEMBL4476593 0.83 MAPK14 (1.00) MAPK14P2RX7MAPK1TDP1MAPT
SCHEMBL4489354 0.77 MAPK14 (0.70) MAPK14FFAR1FFAR4P2RX7ALDH1A1
SCHEMBL4380170 0.77 MAPK14 (0.77) MAPK14MAPK1TDP1MAPTL3MBTL1
SCHEMBL3522684 0.72 ALDH1A1 (0.48) MAPK14P2RX7MAPK1TDP1ALDH1A1
SCHEMBL4376402 0.71 MAPK14 (0.76) MAPK14MAPTALDH1A1SMN1; SMN2
SCHEMBL4488411 0.71 MAPK14 (0.74) MAPK14ALDH1A1KDM4EHPGD
SCHEMBL6509223 0.70 MAPK14 (0.64) MAPK14ALDH1A1
SCHEMBL4381283 0.69 MAPK14 (0.79) MAPK14MAPTALDH1A1KDM4EMEN1
SCHEMBL18401064 0.69 MAPK14 (0.64) MAPK14FFAR4MAPK1TDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP disclosed