SCHEMBL1701664

SCHEMBL1701664

CCCC(=O)CC(=O)CCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.53
CES1 P23141 3/20 0.53
HDAC3 O15379 4/20 0.50
HDAC1 Q13547 4/20 0.50
HDAC2 Q92769 4/20 0.50
HDAC8 Q9BY41 4/20 0.50
FFAR3 O14843 3/20 0.50
HDAC6 Q9UBN7 1/20 0.50
CTSD P07339 1/20 0.48
TSHR P16473 1/20 0.47
ALDH1A1 P00352 1/20 0.45
HAO1 Q9UJM8 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.39
KDM6B O15054 1/20 0.39
KDM5C P41229 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
PHF8 Q9UPP1 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
CASP2 P42575 1/20 0.39

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
SCHEMBL3126473 0.97 CES2 (0.50) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL5667473 0.97 CES2 (0.50) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL11434918 0.97 CES2 (0.50) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL29053185 0.97 CES2 (0.50) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL8101925 0.94 CES2 (0.47) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL451525 0.91 TDP1 (0.50) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL28721169 0.88 TDP1 (0.47) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL534886 0.88 CES1 (0.52) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL13500515 0.88 TDP1 (0.47) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL29587080 0.88 TDP1 (0.47) CES2CES1HDAC3HDAC1HDAC2

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 292 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250051507-A1 Polyol Composition COVESTRO DEUTSCHLAND AG (DE) 2025-02-13 US claimed
EP-4267643-B1 A METHOD FOR STABLY STORING AN ISOCYANATE COMPOSITION COVESTRO DEUTSCHLAND AG (DE) 2025-01-01 EP claimed
US-12162977-B2 Blocked polyisocyanate crosslinking agent, its preparation method and a coating composition comprising the same BASF COATINGS GMBH (DE) 2024-12-10 US claimed
EP-4448609-A1 POLYOL COMPOSITION Covestro Deutschland AG (DE) 2024-10-23 EP claimed
US-20240124680-A1 A METHOD FOR STABLY STORING AN ISOCYANATE COMPOSITION COVESTRO DEUTSCHLAND AG (DE) 2024-04-18 US claimed
CN-114729100-B Blocked polyisocyanate crosslinking agent, process for producing the same and coating composition comprising the same 巴斯夫涂料有限公司 2024-04-16 CN claimed
EP-4267643-A1 A METHOD FOR STABLY STORING AN ISOCYANATE COMPOSITION Covestro Deutschland AG (DE) 2023-11-01 EP claimed
EP-4227339-A1 POLYOL COMPOSITION Covestro Deutschland AG (DE) 2023-08-16 EP claimed
CN-116601141-A Method for stably storing isocyanate composition 科思创德国股份有限公司 2023-08-15 CN claimed
WO-2023110560-A1 POLYOL COMPOSITION COVESTRO DEUTSCHLAND AG (DE) 2023-06-22 WO claimed
US-20160068618-A1 METHYLENE BETA-DIKETONE MONOMERS, METHODS FOR MAKING METHYLENE BETA-DIKETONE MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM SIRRUS, INC. 2016-03-10 US claimed
US-20140275400-A1 METHYLENE BETA-DIKETONE MONOMERS, METHODS FOR MAKING METHYLENE BETA-DIKETONE MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM SIRRUS, INC. 2014-09-18 US claimed
EP-2768897-A2 METHYLENE BETA-DIKETONE MONOMERS, METHODS FOR MAKING METHYLENE BETA-DIKETONE MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM Bioformix Inc. (US) 2014-08-27 EP claimed
WO-2013059479-A2 METHYLENE BETA-DIKETONE MONOMERS, METHODS FOR MAKING METHYLENE BETA-DIKETONE MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM BIOFORMIX INC. (US) 2013-04-25 WO claimed
EP-0912467-B1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE SA (FR) 2002-04-24 EP claimed
EP-0912467-A1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE (FR) 1999-05-06 EP claimed
WO-1998000375-A1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE (FR) 1998-01-08 WO claimed
US-4537920-A 4H-1-benzopyrans and lubricant compositions containing same ETHYL CORPORATION (US) 1985-08-27 US claimed
US-4456770-A Chemical process for preparing 1,3 diketones ETHYL CORPORTATION (US) 1984-06-26 US claimed
US-4456771-A Chemical process for preparing 1,3-diketones ETHYL CORPORATION (US) 1984-06-26 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240124680-A1 A METHOD FOR STABLY STORING AN ISOCYANATE COMPOSITION IDH3A, IDH1, IDH2 CES2 347/4885CES1 3499/4885HDAC3 386/4885
US-20140275400-A1 METHYLENE BETA-DIKETONE MONOMERS, METHODS FOR MAKING METHYLENE BETA-DIKETONE MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM BCKDK, ILK, PKM CES2 3761/4885CES1 3934/4885HDAC3 3845/4885
US-20160068618-A1 METHYLENE BETA-DIKETONE MONOMERS, METHODS FOR MAKING METHYLENE BETA-DIKETONE MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM MSMO1, PKM, KHK CES2 3526/4885CES1 3525/4885HDAC3 4225/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.