SCHEMBL7255174

SCHEMBL7255174

CCOC(=O)NCCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
NCOR2 Q9Y618 1/20 0.46
ACHE P22303 8/20 0.45
GLA P06280 1/20 0.45
KMT2A Q03164 1/20 0.45
EGLN1 Q9GZT9 1/20 0.44
EPHX2 P34913 2/20 0.43
PLA2G2A P14555 1/20 0.43
HTT P42858 1/20 0.42
ECE1 P42892 1/20 0.42

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
Hydrochloric Acid SCHEMBL27336202 0.98 HDAC3 (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15549930 0.88 HTT (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL14979023 0.86 EPHX2 (0.57) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27147999 0.85 HDAC3 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9830057 0.84 EPHX2 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29834112 0.84 ACHE (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
Valeric Acid SCHEMBL28335636 0.83 ACHE (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1425763 0.83 GAA (0.52) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27495408 0.83 ACHE (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL22691294 0.81 LMNA (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106674169-A Preparation method of carbofuran derivatives 湖南海利常德农药化工有限公司 2017-05-17 CN claimed
WO-2024043313-A1 REVERSIBLE THERMOCHROMIC COMPOSITION, MICROENCAPSULATED PIGMENT USING SAID REVERSIBLE THERMOCHROMIC COMPOSITION, WRITING TOOL, AND TOY 三菱ケミカル株式会社 2024-02-29 WO disclosed
WO-2023214576-A1 CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT ON HRAS AND NRAS 中外製薬株式会社 2023-11-09 WO disclosed
EP-3331851-A1 BETA-SUBSTITUTED BETA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS AND USES THEREOF Quadriga Biosciences, Inc. (US) 2018-06-13 EP disclosed
CN-106674169-A Preparation method of carbofuran derivatives 湖南海利常德农药化工有限公司 2017-05-17 CN disclosed
WO-2017024009-A1 BETA-SUBSTITUTED BETA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS AND USES THEREOF QUADRIGA BIOSCIENCES, INC. (US) 2017-02-09 WO disclosed
WO-2003066624-A1 PYRIMIDINONESULFAMOYLUREAS AS INTEGRIN LIGANDS ABBOTT GMBH & CO. KG (DE) 2003-08-14 WO disclosed
EP-0760236-A1 Deformable oil-based foam composition, containing a fluorated surfactant L'OREAL (FR) 1997-03-05 EP disclosed
US-5466858-A Ruthenium catalyst, high selectivity with a carboxylic acid UBE INDUSTRIES, LTD. (JP) 1995-11-14 US disclosed
EP-0342541-A2 Retroviral protease inhibitors ABBOTT LABORATORIES (US) 1989-11-23 EP disclosed