Phosphonic Acid

Phosphonic Acid

SCHEMBL9616586

COC(C)c1cccc(OC(=O)C(C)(C)C)c1.O=[PH](O)O

nearest known ligand 0.44

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Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.44
ELANE P08246 10/20 0.43
BCHE P06276 3/20 0.41
FAAH O00519 1/20 0.40
PTGS1 P23219 1/20 0.38
MARK4 Q96L34 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
SCHEMBL8581995 0.81 ELANE (0.49) ACHEELANEBCHE
SCHEMBL9838475 0.80 ELANE (0.42) ACHEELANEBCHE
SCHEMBL9638837 0.76 ELANE (0.43) ACHEELANEBCHE
SCHEMBL29201240 0.74 L3MBTL1 (0.48) ACHE
Phosphonic Acid SCHEMBL9638832 0.74 ELANE (0.45) ACHEELANE
SCHEMBL9871104 0.71 ELANE (0.52) ELANE
Hydrochloric Acid SCHEMBL11186884 0.71 L3MBTL1 (0.48) ELANE
Phosphonic Acid SCHEMBL8582001 0.71 ELANE (0.39) ELANEFAAH
SCHEMBL8582000 0.71 POLB (0.41) ACHEELANEBCHEFAAH
SCHEMBL18791204 0.71 CYP3A4 (0.67) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0441948-A4 SYNTHESIS OF STABLE, WATER-SOLUBLE CHEMILUMINESCENT 1,2-DIOXETANES AND INTERMEDIATES THEREFOR 1992-06-03 EP disclosed
EP-0441948-A1 SYNTHESIS OF STABLE, WATER-SOLUBLE CHEMILUMINESCENT 1,2-DIOXETANES AND INTERMEDIATES THEREFOR TROPIX, INC. (US) 1991-08-21 EP disclosed