SCHEMBL28061441

SCHEMBL28061441

CCC(=O)OC(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
ELANE P08246 1/20 0.35
ALDH1A1 P00352 3/20 0.35
SOAT1 P35610 1/20 0.35
DGAT1 O75907 1/20 0.34
CA12 O43570 2/20 0.32
CA14 Q9ULX7 2/20 0.32
CA1 P00915 2/20 0.32
CA7 P43166 2/20 0.32
CA2 P00918 2/20 0.32
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NAAA Q02083 1/20 0.32
TDP1 Q9NUW8 3/20 0.31
CTSK P43235 1/20 0.31
CYP2D6 P10635 1/20 0.31
FFAR3 O14843 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
SCHEMBL7181935 0.84 ALDH1A1 (0.58) HDAC6HDAC1HDAC2ELANEALDH1A1
SCHEMBL12735830 0.82 TDP1 (0.36) HDAC6HDAC1HDAC2ELANEALDH1A1
Alcohol SCHEMBL27484758 0.82 SOAT1 (0.42) HDAC6HDAC1HDAC2ELANEALDH1A1
SCHEMBL28378968 0.81 ALDH1A1 (0.39) HDAC6HDAC1HDAC2ALDH1A1SOAT1
SCHEMBL63935 0.81
SCHEMBL13819665 0.81 HDAC6 (0.34) HDAC6HDAC1HDAC2ELANEDGAT1
SCHEMBL848847 0.81 HDAC6 (0.34) HDAC6HDAC1HDAC2ELANEDGAT1
SCHEMBL28960055 0.81 HDAC6 (0.46) HDAC6HDAC1HDAC2ELANEALDH1A1
SCHEMBL29278392 0.81 HDAC6 (0.38) HDAC6HDAC1HDAC2ELANEALDH1A1
SCHEMBL5452 0.81 DGAT1 (0.42) HDAC6HDAC1HDAC2ELANEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122070276-A Prodrugs of xanomeline, prodrugs of trospium chloride and methods of using the same 人类生物科学股份有限公司 2026-05-19 CN disclosed
EP-4705289-A1 PRODRUGS OF XANOMELINE, PRODRUGS OF TROSPIUM AND METHODS OF USE THEREOF Terran Biosciences Inc. (US) 2026-03-11 EP disclosed
WO-2024226691-A1 PRODRUGS OF XANOMELINE, PRODRUGS OF TROSPIUM AND METHODS OF USE THEREOF TERRAN BIOSCIENCES INC. (US) 2024-10-31 WO disclosed
CN-109640658-B Process for preparing 4-alkoxy-3- (acyl or aliphatic saturated hydrocarbyl) oxypyridine carboxamides 美国陶氏益农公司 2021-07-27 CN disclosed
CN-109640657-B Process for preparing 4-alkoxy-3- (acyl or aliphatic saturated hydrocarbyl) oxypyridine carboxamides 美国陶氏益农公司 2020-10-30 CN disclosed
CN-102803252-B Be used for the treatment of indole amides derivative and the related compound thereof of neurodegenerative disorders K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2016-05-25 CN disclosed