SCHEMBL8575015

SCHEMBL8575015

Cc1ccc(S(=O)(=O)N(CCCCC(=O)O)C(=O)c2c3ccccc3nc3cccc(Cc4ccccc4)c23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
KEAP1 Q14145 2/20 0.37
NFE2L2 Q16236 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TAS2R14 Q9NYV8 2/20 0.36
C1R P00736 1/20 0.35
PRSS1 P07477 1/20 0.35
PTGER1 P34995 1/20 0.35
CNR2 P34972 2/20 0.34
POLB P06746 2/20 0.34
KMT2A Q03164 2/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA4 P22748 2/20 0.34
CA9 Q16790 2/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL8578075 0.99 LMNA (0.36) LMNAKEAP1NFE2L2ALDH1A1TAS2R14
SCHEMBL8577942 0.91 KMT2A (0.43) LMNAKEAP1NFE2L2ALDH1A1TAS2R14
SCHEMBL8576213 0.88 ALDH1A1 (0.44) LMNAKEAP1NFE2L2ALDH1A1C1R
SCHEMBL8574327 0.87 KEAP1 (0.47) LMNAKEAP1NFE2L2ALDH1A1TAS2R14
SCHEMBL8574639 0.86 KEAP1 (0.46) LMNAKEAP1NFE2L2ALDH1A1TAS2R14
SCHEMBL18114374 0.84 KEAP1 (0.48) LMNAKEAP1NFE2L2ALDH1A1TAS2R14
SCHEMBL9353204 0.80 KEAP1 (0.50) LMNAKEAP1NFE2L2ALDH1A1TAS2R14
SCHEMBL8573276 0.79 KEAP1 (0.39) LMNAKEAP1NFE2L2ALDH1A1TAS2R14
SCHEMBL8577857 0.77 MEN1 (0.51) KEAP1NFE2L2C1RPRSS1CNR2
SCHEMBL9349485 0.77 KEAP1 (0.46) LMNAKEAP1NFE2L2ALDH1A1POLB

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 6 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