Phosphonic Acid

Phosphonic Acid

SCHEMBL5159546

CCC(CC)(OC)c1cc(NC(=O)C(F)(F)F)cc(OC)c1.O=[PH](O)O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PDK1 Q15118 1/20 0.40
PDK2 Q15119 1/20 0.40
PDK3 Q15120 1/20 0.40
PDK4 Q16654 1/20 0.40
EPHX2 P34913 1/20 0.39
TMPRSS4 Q9NRS4 1/20 0.39
KDM4E B2RXH2 5/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MITF O75030 1/20 0.36

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
SCHEMBL144943 0.77 CYP1A2 (0.58) MAPTNPC1RAB9ASMN1; SMN2POLB
Phosphonic Acid SCHEMBL7599302 0.74 ALDH1A1 (0.32) POLBKMT2A
Phosphonic Acid SCHEMBL5162936 0.74 MARS1 (0.32) POLBKMT2ATMPRSS4
Phosphonic Acid SCHEMBL5164460 0.73 ELANE (0.37) SMN1; SMN2POLBKMT2AKDM4E
SCHEMBL5159536 0.71 KMT2A (0.41) MAPTNPC1RAB9ASMN1; SMN2POLB
Phosphonic Acid SCHEMBL5159602 0.70 MEN1 (0.38) MAPTNPC1SMN1; SMN2POLBKMT2A
SCHEMBL1975027 0.70 ALDH1A1 (0.39) NPC1SMN1; SMN2POLBKMT2AKDM4E
Phosphonic Acid SCHEMBL8583461 0.70 CES2 (0.40) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL4572080 0.69 PDK1 (0.74) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL5142357 0.68 POLB (0.57) MAPTSMN1; SMN2POLBKMT2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1120423-B1 Improved chemiluminescent 1,2-dioxetanes APPLERA CORP (US) 2007-03-14 EP disclosed
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-6140495-A SPIROADAMANTYL DIOXETANES BEARING AN ALKOXY SUBSTITUENT AND AN AROMATIC SUBSTITUENT OF PHENYL OR NAPHTHYL ON THE DIOXETANE RING; REPORTER MOLECULES FOR MEASUREMENT OF ENZYMATIC ACTIVITY TROPIX, INC. (US) 2000-10-31 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-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
US-5538847-A Chemiluminescent 1,2-dioxetanes TROPIX, INC. (US) 1996-07-23 US disclosed
EP-0649417-A1 IMPROVED CHEMILUMINESCENT 1,2-DIOXETANES TROPIX, INC. (US) 1995-04-26 EP disclosed
EP-0649417-A4 IMPROVED CHEMILUMINESCENT 1,2-DIOXETANES. TROPIX INC (US) 1995-02-27 EP disclosed
WO-1994026726-A1 IMPROVED CHEMILUMINESCENT 1,2-DIOXETANES TROPIX, INC. (US) 1994-11-24 WO disclosed