SCHEMBL8308765

SCHEMBL8308765

CC(=NNc1ccc(S(C)(=O)=O)cc1)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.68
MGLL Q99685 6/20 0.68
GAA P10253 5/20 0.52
RAB9A P51151 5/20 0.52
MAPT P10636 4/20 0.52
NPC1 O15118 3/20 0.52
POLB P06746 1/20 0.52
CASP6 P55212 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
PTGS2 P35354 1/20 0.51
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 1/20 0.50
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
CA9 Q16790 3/20 0.49
CA12 O43570 2/20 0.49

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
SCHEMBL517206 0.88 MAPT (0.56) FAAHMGLLGAARAB9AMAPT
SCHEMBL23928536 0.85 FAAH (0.70) FAAHMGLLGAARAB9AMAPT
SCHEMBL23928652 0.82 FAAH (0.54) FAAHMGLLGAARAB9AMAPT
SCHEMBL23928604 0.82 GAA (0.60) FAAHMGLLGAARAB9AMAPT
SCHEMBL23928617 0.81 FAAH (0.52) FAAHMGLLGAARAB9AMAPT
SCHEMBL23928537 0.81 MAPT (0.67) FAAHMGLLGAARAB9AMAPT
SCHEMBL3273659 0.81 GAA (0.69) GAARAB9AMAPTNPC1POLB
SCHEMBL4413307 0.81 GAA (0.69) GAARAB9AMAPTNPC1POLB
SCHEMBL13345208 0.81 GAA (0.69) GAARAB9AMAPTNPC1POLB
SCHEMBL23928577 0.80 GAA (0.53) FAAHMGLLGAARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915848-A1 1,2-DIARYLINDOLE AS COX-2 INHIBITORS LABORATOIRES UPSA (FR) 1999-05-19 EP disclosed
US-5723485-A ANALGESIC, ANTIINFLAMMATORY AGENTS LABORATORIES UPSA (FR) 1998-03-03 US disclosed
WO-1998005639-A1 1,2-DIARYLINDOLE AS COX-2 INHIBITORS LABORATOIRES UPSA (FR) 1998-02-12 WO disclosed