SCHEMBL7755153

SCHEMBL7755153

CC(C)(C)[Si](C)(C)Oc1ccc(OC(=S)c2c3ccccc3nc3ccccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.37
CA1 P00915 4/20 0.37
CA9 Q16790 4/20 0.37
ATM Q13315 1/20 0.35
ELANE P08246 1/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35
PREP P48147 4/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 3/20 0.34
TP53 P04637 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
GAA P10253 1/20 0.33
KDM1A O60341 1/20 0.33
RAD52 P43351 1/20 0.33
GFER P55789 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 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
SCHEMBL2986968 0.84 MAPT (0.46) CA12CA1CA9KMT2AMEN1
SCHEMBL7756511 0.81 KDM4E (0.48) KMT2AMEN1POLBMAPTTP53
SCHEMBL7027183 0.80 POLB (0.51) KMT2AMEN1POLBMAPTTP53
SCHEMBL7030411 0.77 SCN9A (0.43) KMT2AMEN1MAPTKDM1AKDM4E
SCHEMBL6931307 0.77 MAPT (0.43) KMT2AMEN1MAPTTP53NPC1
SCHEMBL7757071 0.77 ESR1 (0.41) KMT2AMEN1MAPTRAB9AGAA
SCHEMBL7040996 0.75 KMT2A (0.45) CA12CA1CA9KMT2AMEN1
SCHEMBL9085712 0.73 MAPT (0.41) CA12CA1CA9KMT2AMEN1
Trifluoromethanesulfonic Acid SCHEMBL7755167 0.73 ACHE (0.33) PREP
SCHEMBL9086145 0.72 PPARG (0.43) KMT2AMEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0755457-B1 Novel Aryl-N-Alkylacridanthiocarboxylate derivatives useful for chemiluminescent detection LUMIGEN INC (US) 2001-02-21 EP disclosed
EP-0755457-A4 NOVEL ARYL-N-ALKYLACRIDANTHIOCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 1997-07-16 EP disclosed
EP-0755457-A1 NOVEL ARYL-N-ALKYLACRIDANTHIOCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1997-01-29 EP disclosed
US-5523212-A OXIDATION WITH PEROXIDE AND PEROXIDASE TO EXCITED ACRIDONE DERIVATIVE; DETECTING PROTEINS, HAPTENS, ANTIBODIES, ENZYMES LUMIGEN, INC. (US) 1996-06-04 US disclosed
WO-1995028495-A1 NOVEL ARYL-N-ALKYLACRIDANTHIOCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1995-10-26 WO disclosed