Ethyl Benzoate

Ethyl Benzoate

SCHEMBL10906112

CCOC(=O)c1ccccc1.[F-].[H+]

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.66
▸ SMN1; SMN2 Q16637 4/20 0.65
▸ RAB9A P51151 3/20 0.65
▸ NPC1 O15118 2/20 0.65
▸ GAA P10253 2/20 0.65
▸ KMT2A Q03164 4/20 0.64
▸ MEN1 O00255 3/20 0.64
▸ CA12 O43570 1/20 0.62
▸ CA1 P00915 1/20 0.62
▸ CA2 P00918 1/20 0.62
▸ ESR1 P03372 1/20 0.62
▸ CA7 P43166 1/20 0.62
▸ CA9 Q16790 1/20 0.62
▸ ESR2 Q92731 1/20 0.62
▸ CA14 Q9ULX7 1/20 0.62
▸ TSHR P16473 2/20 0.61
▸ CYP1A2 P05177 1/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ MAOA P21397 1/20 0.60
▸ TDP1 Q9NUW8 2/20 0.59

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
Ethyl Benzoate SCHEMBL2762273 0.96 LMNA (0.70) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL55674 0.96 LMNA (0.70) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL25388294 0.96 LMNA (0.70) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL1404143 0.94 LMNA (0.68) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL28871046 0.94 LMNA (0.68) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL28365249 0.94 LMNA (0.68) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL595705 0.94 LMNA (0.68) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL9345283 0.94 LMNA (0.68) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL30886688 0.94 LMNA (0.68) LMNASMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL10340677 0.94 LMNA (0.68) LMNASMN1; SMN2RAB9ANPC1GAA

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-0093075-B1 PREPARATION OF HIGH CIS-1,4-POLYBUTADIENE THE GOODYEAR TIRE & RUBBER COMPANY (US) 1986-12-30 — — EP disclosed
EP-0093075-A1 Preparation of high cis-1,4-polybutadiene THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-11-02 — — EP disclosed
Send feedback