SCHEMBL42782

SCHEMBL42782

c1cc(C2CCCCC2)ccc1C1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.52
HDAC6 Q9UBN7 2/20 0.52
HDAC1 Q13547 1/20 0.52
HTT P42858 2/20 0.52
LMNA P02545 1/20 0.52
KMT2A Q03164 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
NOTUM Q6P988 2/20 0.50
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
HSP90AA1 P07900 1/20 0.50
CYP11B2 P19099 1/20 0.50
HAO1 Q9UJM8 2/20 0.48
ESR2 Q92731 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GLA P06280 1/20 0.47
HIF1A Q16665 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ACMSD Q8TDX5 1/20 0.47

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
SCHEMBL6275125 1.00 HDAC8 (0.52) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL15260520 1.00 HDAC8 (0.52) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL28584923 1.00 HDAC8 (0.52) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL5146632 0.97 ESR2 (0.52) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL781509 0.97 HDAC1 (0.54) HDAC8HDAC6HDAC1HTTLMNA
Hydrogen Peroxide SCHEMBL11391495 0.94 HAO1 (0.55) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL5147779 0.93 ESR2 (0.54) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL59138 0.91 NOTUM (0.55) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL5886587 0.90 ESR2 (0.56) HDAC8HDAC6HDAC1HTTLMNA
SCHEMBL28451253 0.88 NOTUM (0.53) HDAC8HDAC6HDAC1HTTLMNA

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

Appears in 2024 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120059683-A Synthetic heat conduction oil and application 中国石油化工股份有限公司 2025-05-30 CN claimed
CN-119899076-A Process for producing cyclohexene 中国石油化工股份有限公司 2025-04-29 CN claimed
CN-119707620-A Production method of cyclohexylbenzene 中国石油化工股份有限公司 2025-03-28 CN claimed
CN-119215789-A Organic hydride dehydrogenation reaction systems and methods 中国石油化工股份有限公司 2024-12-31 CN claimed
CN-115305065-B Synthetic high-temperature heat carrier 中国石油化工股份有限公司 2024-11-29 CN claimed
CN-118879339-A Wide-temperature-range liquid crystal material and preparation method and application thereof 北京大学 2024-11-01 CN claimed
CN-115305066-B Polycyclic aromatic hydrocarbon heat conduction composition 中国石油化工股份有限公司 2024-08-30 CN claimed
CN-115305067-B Synthetic heat conduction oil 中国石油化工股份有限公司 2024-07-23 CN claimed
CN-112221521-B Catalyst, preparation method thereof and method for preparing cyclohexylbenzene 中国石油化工股份有限公司 2024-05-17 CN claimed
CN-117985652-A Organic hydride dehydrogenation reaction systems and methods 中国石油化工股份有限公司 2024-05-07 CN claimed
US-5139698-A Achiral liquid crystal compound with doping component MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-08-18 US claimed
US-5043093-A Liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-08-27 US claimed
EP-0408995-A2 Liquid crystal medium with limited temperature-dependence of the d/p coefficient MERCK PATENT GmbH (DE) 1991-01-23 EP claimed
EP-0152808-B1 NITROGEN CONTAINING HETEROCYCLES MERCK PATENT GmbH (DE) 1990-09-12 EP claimed
EP-0209622-B1 HYDROTERPHENYLS MERCK PATENT GmbH (DE) 1989-06-07 EP claimed
EP-0164417-B1 THERMAL RECORDING MATERIAL NIPPON STEEL CHEMICAL CO., LTD. (JP) 1989-03-15 EP claimed
US-4702562-A MIXTURE-FOR MULTIPLEXING MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1987-10-27 US claimed
EP-0164417-A1 THERMAL RECORDING MATERIAL NIPPON STEEL CHEMICAL CO., LTD. (JP) 1985-12-18 EP claimed
US-4171245-A Extractive distillation with hydrocarbon solvent of mixture of hydrocarbyl aromatic compound, hydroxy aromatic compound and carbonyl compound PHILLIPS PETROLEUM COMPANY (US) 1979-10-16 US claimed
US-3984490-A Phenylcyclohexane formed by cracking dicyclohexylbenzene THE UPJOHN COMPANY (US) 1976-10-05 US claimed