SCHEMBL8469774

SCHEMBL8469774

Cc1ccc(S(=O)(=O)N(C(=O)c2c3ccccc3[n+](C)c3ccccc23)c2ccc(CC(=O)ON3C(=O)CCC3=O)cc2)cc1.O=S(=O)([O-])F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
TP53 P04637 4/20 0.36
MAPT P10636 6/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
GAA P10253 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HSP90AA1 P07900 1/20 0.33
CNR2 P34972 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
CTSG P08311 1/20 0.33
CMA1 P23946 1/20 0.33

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
SCHEMBL31163692 0.97 LMNA (0.40) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8472099 0.93 TP53 (0.35) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8470372 0.89 TP53 (0.37) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8470361 0.89 LMNA (0.41) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8469537 0.85 ALDH1A1 (0.39) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8469903 0.85 LMNA (0.40) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8469668 0.83 ALDH1A1 (0.37) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8469304 0.81 TSHR (0.39) LMNATP53MAPTGAAKEAP1
Trifluoromethanesulfonic Acid SCHEMBL4426555 0.81 ALDH1A1 (0.37) LMNATP53MAPTCYP1A2CYP3A4
SCHEMBL8469910 0.78 LMNA (0.38) LMNATP53MAPTCYP1A2CYP3A4

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
US-6002007-A Special chemiluminescent acridine derivatives and the use thereof in luminescence immunoassays DADE BEHRING MARBURG GMBH (DE) 1999-12-14 US disclosed
US-5879953-A Special chemiluminescent acridine derivatives and the use thereof in luminescence immunoassays HOECHST AKTIENGESELLSCHAFT (DE) 1999-03-09 US disclosed
US-5783696-A Special chemiluminescent acridine derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1998-07-21 US disclosed