Ethyl Acetate

Ethyl Acetate

SCHEMBL7986575

CCOC(C)=O.O=C1CCCC1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.61
LMNA P02545 4/20 0.61
HSD17B10 Q99714 3/20 0.61
TRIM24 O15164 2/20 0.43
TRIM33 Q9UPN9 2/20 0.43
TSHR P16473 1/20 0.40
CYP2D6 P10635 1/20 0.38
GAA P10253 3/20 0.37
HPGD P15428 3/20 0.37
MAPT P10636 3/20 0.37
ALOX15 P16050 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.37
BRD4 O60885 1/20 0.36
MGAM O43451 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
SOAT1 P35610 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35

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
Cyclohexanone SCHEMBL2259986 0.98 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10TRIM24TRIM33
Cycloheptanone SCHEMBL10412695 0.98 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10TRIM24TRIM33
Toluene SCHEMBL29256806 0.86 ALDH1A1 (0.45) ALDH1A1LMNAHSD17B10TSHRCYP2D6
Cyclohexanone SCHEMBL30818023 0.86 ALDH1A1 (0.45) ALDH1A1LMNAHSD17B10TRIM24TRIM33
Cyclopentanone SCHEMBL3267093 0.83 TRIM24 (0.43) ALDH1A1LMNAHSD17B10TRIM24TRIM33
Acetic Acid Propyl Ester SCHEMBL28249188 0.82 ALDH1A1 (0.47) ALDH1A1LMNAHSD17B10TRIM24TRIM33
Cyclohexane SCHEMBL1172967 0.81 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Cyclohexane SCHEMBL232777 0.81 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Cyclohexane SCHEMBL509143 0.81 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Cyclohexane SCHEMBL416739 0.81 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115466201-A Sulfonic acid modified polyisocyanate and preparation method thereof 万华化学集团股份有限公司 2022-12-13 CN claimed
CN-116890554-A Patterning method of crosslinked cholesteric liquid crystal film 苏州苏凯路化学科技有限公司 2023-10-17 CN disclosed
CN-115466201-A Sulfonic acid modified polyisocyanate and preparation method thereof 万华化学集团股份有限公司 2022-12-13 CN disclosed
EP-3045485-B1 POLYISOCYANATE MODIFIED WITH SULPHAMIC ACID, PREPARATION METHOD THEREFOR AND USE THEREOF WANHUA CHEMICAL GROUP CO LTD (CN) 2020-03-25 EP disclosed
US-9975985-B2 Polyisocyanate modified with sulphamic acid, preparation method thereof and use thereof WANHUA CHEMICAL GROUP CO., LTD. (CN) 2018-05-22 US disclosed
CN-104448232-B Polyisocyanates that a kind of sulfamic acid is modified and its production and use 万华化学集团股份有限公司 2017-12-15 CN disclosed
CN-104684960-B polycarboxylic acid resin and epoxy resin composition 日本化药株式会社 2017-05-10 CN disclosed
US-20160280836-A1 POLYISOCYANATE MODIFIED WITH SULPHAMIC ACID, PREPARATION METHOD THEREOF AND USE THEREOF WANHUA CHEMICAL GROUP CO., LTD. (CN) 2016-09-29 US disclosed
EP-3045485-A1 POLYISOCYANATE MODIFIED WITH SULPHAMIC ACID, PREPARATION METHOD THEREFOR AND USE THEREOF Wanhua Chemical Group Co., Ltd. (CN) 2016-07-20 EP disclosed
CN-104448232-A Sulfamic acid modified polyisocyanate and preparation method and application thereof WANHUA CHEMICAL GROUP CO LTD 2015-03-25 CN disclosed
US-6284036-B1 PIGMENTING POROUS SINTERED MATERIAL COMPRISING BORIDE, CARBIDE, SILICIDE, NITRIDE OR PHOSPHIDES BY APPLYING SOLUTION OF SOLUBLE PIGMENT DERIVATIVE AND REGENERATING ORGANIC PIGMENT BY HEATING TO DEPOSIT PIGMENT IN PORES CIBA SPECIALTY CHEMICALS CORPORATION 2001-09-04 US disclosed