SCHEMBL5199192

SCHEMBL5199192

Fc1ccccc1C[CH]c1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.41
IDO1 P14902 3/20 0.40
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRIN2C Q14957 2/20 0.38
GRIN3A Q8TCU5 2/20 0.38
NFE2L2 Q16236 2/20 0.38
TNF P01375 1/20 0.37
IL6 P05231 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
LMNA P02545 2/20 0.37
PTGS2 P35354 1/20 0.37
NR1I2 O75469 1/20 0.36
NR3C1 P04150 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
PTGES2 Q9H7Z7 1/20 0.36

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
SCHEMBL8112257 0.81 NFE2L2 (0.50) IDO1NFE2L2TAAR1LMNA
SCHEMBL1133197 0.75 ALDH1A1 (0.41) IDO1NFE2L2TAAR1LMNA
SCHEMBL3721541 0.74 NFKB1 (0.48) NFKB1IDO1GRIN2DGRIN3BGRIN1
SCHEMBL27947936 0.72 NFKB1 (0.52) NFKB1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5199196 0.72 TAAR1 (0.54) IDO1TAAR1PTGS2MAOB
SCHEMBL8397406 0.70 TAAR1 (0.45) IDO1NFE2L2TAAR1LMNA
SCHEMBL5610552 0.69 NFKB1 (0.44) NFKB1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11601066 0.69 NFKB1 (0.44) NFKB1IDO1GRIN2DGRIN3BGRIN1
SCHEMBL27865982 0.69 NFKB1 (0.49) NFKB1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5542863 0.69 NFKB1 (0.44) NFKB1IDO1GRIN2DGRIN3BGRIN1

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-1814863-A1 INDAZOLE SULPHONAMIDE DERIVATIVES AstraZeneca AB (SE) 2007-08-08 EP disclosed
WO-2006052190-A1 INDAZOLE SULPHONAMIDE DERIVATIVES ASTRAZENECA AB (SE) 2006-05-18 WO disclosed