Ethyl Acetate

Ethyl Acetate

SCHEMBL27610052

Brc1ccc(Br)cc1.CCOC(C)=O

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.64
▸ LMNA P02545 3/20 0.64
▸ HSD17B10 Q99714 1/20 0.64
▸ MAPT P10636 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ NPSR1 Q6W5P4 3/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ S1PR4 O95977 1/20 0.55
▸ S1PR1 P21453 1/20 0.55
▸ HTT P42858 1/20 0.49
▸ TSHR P16473 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ TARBP2 Q15633 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ NHERF1 O14745 1/20 0.44

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
Bromobenzene SCHEMBL27771837 0.90 ALDH1A1 (0.56) ALDH1A1LMNAHSD17B10MAPTKMT2A
Ethyl Acetate SCHEMBL27930073 0.87 LMNA (0.48) ALDH1A1LMNAHSD17B10MAPTKMT2A
Ethyl Acetate SCHEMBL27558575 0.86 LMNA (0.47) ALDH1A1LMNAHSD17B10MAPTKMT2A
Ethyl Acetate SCHEMBL27610053 0.83 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10MAPTKMT2A
Acetic Acid Propyl Ester SCHEMBL27591957 0.83 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10MAPTKMT2A
Ethyl Acetate SCHEMBL11018083 0.81 ALDH1A1 (0.70) ALDH1A1LMNAHSD17B10TSHRCYP1A2
P-Xylene SCHEMBL2536913 0.81 ALDH1A1 (0.70) ALDH1A1LMNAHSD17B10MAPTKMT2A
Ethyl Acetate SCHEMBL28816628 0.80 — —
Ethyl Acetate SCHEMBL70316 0.80 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10TSHRSMN1; SMN2
Ethyl Acetate SCHEMBL28615209 0.80 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10TSHRSMN1; SMN2

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
CN-101386658-A Process for producing copolymer SUMITOMO CHEMICAL CO (JP) 2009-03-18 — — CN disclosed
CN-100404565-C Process for producing copolymer SUMITOMO CHEMICAL CO (JP) 2008-07-23 — — CN disclosed
CN-1576288-A Process for producing copolymer SUMITOMO CHEMICAL CO (JP) 2005-02-09 — — CN disclosed
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