SCHEMBL8573276

SCHEMBL8573276

Cc1ccc(S(=O)(=O)N(CCC(=O)O)C(=O)c2c3ccccc3nc3cccc(C(C)(C)C)c23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 3/20 0.39
NFE2L2 Q16236 3/20 0.39
LMNA P02545 4/20 0.39
C1R P00736 1/20 0.37
PRSS1 P07477 1/20 0.37
POLB P06746 1/20 0.36
PDE10A Q9Y233 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
NCF1 P14598 1/20 0.35
GBA1 P04062 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL9353204 0.87 KEAP1 (0.50) KEAP1NFE2L2LMNAC1RPRSS1
SCHEMBL9074212 0.83 PRSS1 (0.38) KEAP1NFE2L2LMNAC1RPRSS1
SCHEMBL18114374 0.81 KEAP1 (0.48) KEAP1NFE2L2LMNAC1RPRSS1
SCHEMBL8574327 0.80 KEAP1 (0.47) KEAP1NFE2L2LMNAC1RPRSS1
SCHEMBL8574639 0.79 KEAP1 (0.46) KEAP1NFE2L2LMNAC1RPRSS1
SCHEMBL8575015 0.79 LMNA (0.37) KEAP1NFE2L2LMNAC1RPRSS1
SCHEMBL8578075 0.78 LMNA (0.36) KEAP1NFE2L2LMNAC1RPRSS1
SCHEMBL8577857 0.76 MEN1 (0.51) KEAP1NFE2L2C1RPRSS1POLB
SCHEMBL9353384 0.74 KEAP1 (0.49) KEAP1NFE2L2LMNAMAPTTAS2R14
SCHEMBL8578103 0.72 C5AR1 (0.49) KEAP1NFE2L2LMNAC1RPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5783699-A MAY BE CONJUGATED TO ANTIGENS, HAPTENS, ANTIBODIES IN IMMUNOASSAYS ABBOTT LABORATORIES (US) 1998-07-21 US disclosed
US-5669819-A IMMUNOASSAY ABBOTT LABORATORIES (US) 1997-09-23 US disclosed
US-5565570-A REACTING AMINE WITH SULFONYL HALIDE IN INERT SOLVENT IN PRESENCE OF BASE TO FORM METAL SALT OF SULFONAMIDE, ACYLATING WITH ACTIVATED PHENANTHRIDINE-6-CARBOXYLIC ACID TO FORM CHEMILUMINESCENT SALT ABBOTT LABORATORIES (US) 1996-10-15 US disclosed
US-5545739-A E.G., 5-METHYL-6-(N-2-CARBOXYETHYL-N=(2-CARBOXYETHYL)-PHENANTHRIDIN IUMCARBOXAMIDE CHLORIDE; IMMUNOASSAYS; STABILITY; SENSITIVITY ABBOTT LABORATORIES (US) 1996-08-13 US disclosed
US-5543524-A FORMING A SULFONAMIDE FROM AND AMINE AND A SULFONYL HALIDE AND AND ACYLATING WITH A CARBONYL HALIDE OF AN ACTIVATED ACRIDINE SALT ABBOTT LABORATORIES (US) 1996-08-06 US disclosed
US-5468646-A Chemiluminescent acridinium salts ABBOTT LABORATORIES (US) 1995-11-21 US disclosed
EP-0273115-B1 Chemiluminescent acridinium and phenanthridinium salts ABBOTT LAB (US) 1994-09-07 EP disclosed
EP-0273115-A2 Chemiluminescent acridinium and phenanthridinium salts ABBOTT LABORATORIES (US) 1988-07-06 EP disclosed