SCHEMBL2531344

SCHEMBL2531344

C1CCC([C](C2CCCCC2)C2CCCCC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
MGLL Q99685 1/20 0.45
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
NOS2 P35228 2/20 0.42
TSHR P16473 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HSD11B1 P28845 3/20 0.36
EPHX1 P07099 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 1/20 0.33
HSD11B2 P80365 1/20 0.33
MAPK1 P28482 1/20 0.32

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
SCHEMBL28990391 1.00 CES2 (0.53) CES2CES1MGLLHDAC8HDAC6
SCHEMBL1317993 1.00 CES2 (0.53) CES2CES1MGLLHDAC8HDAC6
SCHEMBL3227064 1.00 CES2 (0.53) CES2CES1MGLLHDAC8HDAC6
SCHEMBL3224880 1.00 CES2 (0.53) CES2CES1MGLLHDAC8HDAC6
SCHEMBL3231716 1.00 CES2 (0.53) CES2CES1MGLLHDAC8HDAC6
SCHEMBL6250105 0.96 CES2 (0.50) CES2CES1MGLLHDAC8HDAC6
SCHEMBL3233671 0.96 CES2 (0.47) CES2CES1MGLLHDAC8HDAC6
SCHEMBL15911101 0.87 NOS2 (0.44) CES2CES1MGLLHDAC8HDAC6
SCHEMBL10482505 0.77 NOS2 (0.38) NOS2
SCHEMBL15703282 0.75 CES2 (0.53) CES2CES1MGLLHDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007118474-A2 METHOD FOR THE PRODUCTION OF HYDROGEN-RICH SILANES, AND NOVEL CHEMICAL COMPOUNDS TECHNISCHE UNIVERSITÄT BERGAKADEMIE FREIBERG (DE) 2007-10-25 WO claimed
EP-4400520-A1 CATALYST FOR OLEFIN POLYMERIZATION AND METHOD FOR PRODUCING OLEFIN POLYMER The University of Tokyo (JP) 2024-07-17 EP disclosed
CN-118176220-A Catalyst for olefin polymerization and process for producing olefin polymer 国立大学法人东京大学 2024-06-11 CN disclosed
US-11981765-B2 Catalyst for olefin polymerization and method for producing polar group—containing olefin polymer THE UNIVERSITY OF TOKYO (JP) 2024-05-14 US disclosed
EP-3786196-B1 METHOD FOR PRODUCING COPOLYMER OF ALLYL MONOMER HAVING POLAR GROUP UNIV TOKYO (JP) 2024-05-08 EP disclosed
WO-2023190912-A1 POLAR-GROUP-CONTAINING OLEFIN COPOLYMER AND METHOD FOR PRODUCING SAME 日本ポリケム株式会社 2023-10-05 WO disclosed
EP-3978537-B1 POLAR GROUP-CONTAINING OLEFIN COPOLYMER UNIV TOKYO (JP) 2023-09-13 EP disclosed
EP-3604362-B1 MULTI-COMPONENT POLAR OLEFIN COPOLYMER AND METHOD FOR PRODUCING SAME JAPAN POLYETHYLENE CORP (JP) 2023-08-02 EP disclosed
US-11697698-B2 Method for producing copolymer of allyl monomer having polar group THE UNIVERSITY OF TOKYO (JP) 2023-07-11 US disclosed
WO-2023100693-A1 CATALYST FOR OLEFIN POLYMERIZATION AND PRODUCTION METHOD FOR OLEFIN-BASED POLYMER 国立大学法人 東京大学 2023-06-08 WO disclosed
US-4689437-A ETHYLENE OR ETHYLENE-PROPYLENE, CATALYST FROM TRANSITION METAL COMPOUND, ACTIVATOR, ORGANOPHOSPHORUS SULFONATE LIGAND UNION CARBIDE CORPORATION (US) 1987-08-25 US disclosed
US-4668823-A ARYLDICHLOROPHOSPHINE, TWO GRIGNARDS UNION CARBIDE CORPORATION (US) 1987-05-26 US disclosed
EP-0207097-A1 NEW CARBONIC ACID ESTERS. CIBA GEIGY AG (CH) 1987-01-07 EP disclosed
WO-1986003747-A1 NEW CARBONIC ACID ESTERS CIBA-GEIGY AG (CH) 1986-07-03 WO disclosed
US-4379149-A Process for introducing an oxygen-containing functional group into ansamycins CIBA-GEIGY CORPORATION (US) 1983-04-05 US disclosed
EP-0049683-A2 Imidazo-rifamycines, process for their preparation, pharmaceutical preparations containing them and their use CIBA-GEIGY AG (CH) 1982-04-14 EP disclosed
US-4322419-A Bicyclomycin derivatives, compositions thereof and process of use thereof CIBA-GEIGY CORPORATION (US) 1982-03-30 US disclosed
EP-0023885-A1 Method for the introduction of an oxygen-containing functional group into ansamycines, compounds thus obtained, and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1981-02-11 EP disclosed
US-4145344-A BICYCLOMYCIN DERIVATIVES CIBA-GEIGY CORPORATION (US) 1979-03-20 US disclosed
US-3965220-A AMINE CATALYST MONSANTO COMPANY (US) 1976-06-22 US disclosed