SCHEMBL19524204

SCHEMBL19524204

CC(=O)c1ccccc1Oc1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 2/20 0.53
SCN10A Q9Y5Y9 2/20 0.53
CTNNB1 P35222 1/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.50
PNLIP P16233 1/20 0.50
LMNA P02545 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPT P10636 1/20 0.49
ALDH1A1 P00352 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
PARP10 Q53GL7 1/20 0.46
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
CRHBP P24387 1/20 0.45
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
CRHR2 Q13324 1/20 0.45
CYP1A2 P05177 1/20 0.45

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
SCHEMBL9638920 0.93 CTNNB1 (0.58) CTNNB1KMT2AMEN1LMNAL3MBTL1
SCHEMBL29679671 0.87 CTNNB1 (0.67) CTNNB1KMT2AMEN1LMNAL3MBTL1
SCHEMBL3179214 0.87 CTNNB1 (0.67) CTNNB1KMT2AMEN1LMNAL3MBTL1
SCHEMBL11604077 0.86 CTNNB1 (0.51) CTNNB1KMT2AMEN1PNLIPLMNA
SCHEMBL4743129 0.86 MAPT (0.62) CTNNB1KMT2AMEN1LMNAL3MBTL1
Hydrochloric Acid SCHEMBL8136102 0.85 CTNNB1 (0.65) CTNNB1KMT2AMEN1LMNAL3MBTL1
SCHEMBL2303571 0.84 MAPT (0.60) CTNNB1KMT2AMEN1PNLIPLMNA
SCHEMBL7755868 0.84 LMNA (0.51) CTNNB1KMT2AMEN1LMNAL3MBTL1
SCHEMBL9367885 0.84 PTGER4 (0.51) SCN8ASCN10APNLIPALDH1A1SMN1; SMN2
SCHEMBL2865011 0.84 CTNNB1 (0.58) SCN8ASCN10ACTNNB1KMT2AMEN1

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-3239134-A1 PYRIDONE AMIDES AS MODULATORS OF SODIUM CHANNELS Vertex Pharmaceuticals Incorporated (US) 2017-11-01 EP disclosed
CN-87108295-A New alkane sulfonyl aniline derivative and its medicinal compositions and preparation method 1988-07-13 CN disclosed