SCHEMBL7599298

SCHEMBL7599298

CCOP(=O)(OCC)C(OC)c1cc(N)cc(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
POLB P06746 1/20 0.38
CA12 O43570 4/20 0.37
CA1 P00915 4/20 0.37
CA2 P00918 4/20 0.37
CA9 Q16790 4/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 2/20 0.35
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL2070455 0.90 L3MBTL1 (0.44) L3MBTL1POLBCA12CA1CA2
SCHEMBL5162933 0.83 L3MBTL1 (0.40) L3MBTL1POLBCA12CA1CA2
SCHEMBL5159594 0.79 TDP1 (0.51) L3MBTL1POLBCA1CA2TDP1
SCHEMBL4801866 0.78 POLB (0.45) L3MBTL1POLBTDP1GAAMAPT
SCHEMBL7027649 0.77 CA12 (0.49) L3MBTL1POLBCA12CA1CA2
SCHEMBL5213994 0.77 POLB (0.42) L3MBTL1POLBCA12CA1CA2
SCHEMBL5164458 0.77 L3MBTL1 (0.38) L3MBTL1POLBTDP1GAA
SCHEMBL8581171 0.73 AKR1C3 (0.48) L3MBTL1CA12CA1CA2CA9
SCHEMBL5159541 0.73 KMT2A (0.39) L3MBTL1POLBTDP1GAAMAPT
SCHEMBL16800062 0.70 POLB (0.62) POLBMAPTKMT2ALMNAALDH1A1

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
US-6346615-B1 SPIROADAMANTYL DIOXETANES BEARING AN ALKOXY SUBSTITUENT, AND AN AROMATIC SUBSTITUENT ON THE DIOXETANE RING CAN BE ACTIVATED TO CHEMILUMINESCE IF THE AROMATIC SUBSTITUENT BEARS A MOIETY THAT IS CLEAVED BY AN ENZYME TROPIX, INC. 2002-02-12 US disclosed
US-6022964-A SPIROADAMANTYL DIOXETANES WITH AN ALKOXY SUBSTITUENT AND A NAPHTHYL SUBSTITUENT ON THE DIOXETANE RING WHICH CAN BE ACTIVATED BY ENZYMATIC CLEAVAGE OF LABILE GROUP; KINETICS AND SIGNAL INTENSITY DEPENDS ON ELECTRON-ACTIVATING GROUP TROPIX, INC. (US) 2000-02-08 US disclosed
US-5851771-A Chemiluminescent 1,2-dioxetanes TROPIX, INC. (US) 1998-12-22 US disclosed
US-5840919-A SPIROADAMANTYL 1,2-DIOXETANES CHARACTERIZED BY SUBSTITUENT ON AROMATIC RING IN ADDITION TO META-SUBSTITUTED ENZYME-LABILE GROUP TROPIX, INC. (US) 1998-11-24 US disclosed