SCHEMBL27770494

SCHEMBL27770494

NCc1c(Cl)cccc1N(CC(=O)NCc1cccc(C=CC(=O)O)c1)S(=O)(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
PTGER1 P34995 5/20 0.49
LMNA P02545 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
RORC P51449 4/20 0.45
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KEAP1 Q14145 2/20 0.42
NFE2L2 Q16236 2/20 0.42
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL27770493 1.00 MAPT (0.49) MAPTPTGER1LMNANPSR1RORC
SCHEMBL15663411 0.93 PTGER1 (0.54) MAPTPTGER1LMNANPSR1RORC
SCHEMBL2174925 0.90 PTGER1 (0.53) MAPTPTGER1LMNANPSR1RORC
SCHEMBL2174921 0.90 PTGER1 (0.53) MAPTPTGER1LMNANPSR1RORC
SCHEMBL27770491 0.87 MAPT (0.52) MAPTPTGER1LMNANPSR1RORC
SCHEMBL27770492 0.86 MAPT (0.53) MAPTPTGER1LMNANPSR1RORC
SCHEMBL2176549 0.83 PTGER1 (0.61) PTGER1LMNARORCALDH1A1SMN1; SMN2
SCHEMBL2176553 0.83 PTGER1 (0.61) PTGER1LMNARORCALDH1A1SMN1; SMN2
SCHEMBL2173616 0.80 PTGER1 (0.55) PTGER1LMNAKMT2AMEN1THRB
SCHEMBL2175487 0.80 PTGER1 (0.59) PTGER1LMNARORCALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101500554-B Sulfonamide compound or salt thereof ASTELLAS PHARMA INC 2012-06-27 CN claimed
CN-101500554-A Sulfonamide compound or salt thereof ASTELLAS PHARMA INC (JP) 2009-08-05 CN claimed
CN-101500554-B Sulfonamide compound or salt thereof ASTELLAS PHARMA INC 2012-06-27 CN disclosed
CN-101500554-A Sulfonamide compound or salt thereof ASTELLAS PHARMA INC (JP) 2009-08-05 CN disclosed