Ethyl Benzoate

Ethyl Benzoate

SCHEMBL9720392

CCCOC(=O)c1ccccc1.CCOC(=O)c1ccccc1

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.89
TDP1 Q9NUW8 3/20 0.63
ALDH1A1 P00352 6/20 0.62
ESR1 P03372 2/20 0.62
TSHR P16473 2/20 0.62
CHRM1 P11229 1/20 0.62
SLC6A2 P23975 1/20 0.62
KDR P35968 1/20 0.62
SMN1; SMN2 Q16637 4/20 0.59
GAA P10253 2/20 0.59
RAB9A P51151 2/20 0.59
NPC1 O15118 1/20 0.59
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
ESR2 Q92731 1/20 0.56

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
SCHEMBL7181498 0.94 LMNA (1.00) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL130761 0.94 LMNA (1.00) LMNATDP1ALDH1A1ESR1TSHR
Hydrochloric Acid SCHEMBL27605432 0.92 LMNA (0.96) LMNATDP1ALDH1A1ESR1TSHR
Methane SCHEMBL28760616 0.92 LMNA (0.96) LMNATDP1ALDH1A1ESR1TSHR
Water SCHEMBL28012190 0.92 LMNA (0.96) LMNATDP1ALDH1A1ESR1TSHR
Methyl Alcohol SCHEMBL28069166 0.92 LMNA (0.96) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL28387455 0.92 LMNA (0.96) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL4465574 0.92 LMNA (0.96) LMNATDP1ALDH1A1ESR1TSHR
SCHEMBL30886680 0.92 LMNA (0.96) LMNATDP1ALDH1A1ESR1TSHR
Alcohol SCHEMBL27464334 0.91 LMNA (0.92) LMNATDP1ALDH1A1ESR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0324835-B1 PROPYLENE POLYMERIZATION CATALYST AND METHOD QUANTUM CHEMICAL CORPORATION (US) 1992-12-02 EP claimed
CN-118852618-A Resin composition 旭化成株式会社 2024-10-29 CN disclosed
CN-103975455-B Organic electronic material, ink composite and organic electronic element 日立化成株式会社 2016-08-17 CN disclosed