SCHEMBL16673246

SCHEMBL16673246

C[N+](C)(C)c1ccccc1[O-]

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
ACHE P22303 2/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL2489382 0.78 APOBEC3A (0.47) APOBEC3AAPOBEC3GACHELMNA
Hydrochloric Acid SCHEMBL6368017 0.76 APOBEC3A (0.45) APOBEC3AAPOBEC3GACHELMNA
SCHEMBL13432835 0.71 APOBEC3A (0.41) APOBEC3AAPOBEC3GACHELMNA
SCHEMBL7763343 0.69 ACHE (0.50) APOBEC3AAPOBEC3GACHE
Catechol SCHEMBL30597603 0.67 TSHR (0.43) ACHELMNA
SCHEMBL11100532 0.67 APOBEC3A (0.36) APOBEC3AAPOBEC3GACHELMNA
SCHEMBL13822644 0.67 LMNA (0.55) ACHELMNA
Water SCHEMBL5327527 0.67 ACHE (0.47) APOBEC3AAPOBEC3GACHE
SCHEMBL16114583 0.67 ACHE (0.43) APOBEC3AAPOBEC3GACHE
Iodide SCHEMBL11777950 0.67 ACHE (0.47) APOBEC3AAPOBEC3GACHE

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
US-20150126703-A1 CATALYZED POLYMERIZATION OF CYCLIC ESTERS AND CYCLIC CARBONATES UNIVERSITE DE MONS (BE) 2015-05-07 US disclosed
EP-2868683-A1 Catalyzed Polymerization of Cyclic Esters and Cyclic Carbonates Université de Mons (BE) 2015-05-06 EP disclosed