SCHEMBL9008331

SCHEMBL9008331

Oc1ccc(C2(c3ccc(O)c(C4CCCCC4)c3)CCCCCCC2)cc1C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.56
ESR2 Q92731 4/20 0.56
HSP90AA1 P07900 1/20 0.53
NUDT1 P36639 1/20 0.49
BACE1 P56817 1/20 0.49
ACHE P22303 1/20 0.40
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ACMSD Q8TDX5 2/20 0.37
THRB P10828 1/20 0.37
LMNA P02545 3/20 0.35
ALOX12 P18054 3/20 0.35
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33

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
SCHEMBL29401448 1.00 ESR1 (0.56) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL3021025 1.00 ESR1 (0.56) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL10595392 1.00 ESR1 (0.56) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL5881414 1.00 ESR1 (0.56) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL20225257 1.00 ESR1 (0.56) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL278620 1.00 ESR1 (0.56) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL10941119 0.94 ESR2 (0.59) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL278720 0.89 ESR1 (0.47) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL28105861 0.87 HSP90AA1 (0.45) ESR1ESR2HSP90AA1NUDT1BACE1
SCHEMBL29108770 0.86 HSP90AA1 (0.44) ESR1ESR2HSP90AA1NUDT1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0331095-B1 Improving stability at moderate temperatures of motor vehicle components shaped from polyvinyl chloride resin compositions WITCO CORP (US) 1996-10-09 EP disclosed
US-4950704-A DIKETONE AS HEAT STABILIZER ARGUS CHEMICAL CORPORATION (US) 1990-08-21 US disclosed
EP-0331095-A1 Improving stability at moderate temperatures of motor vehicle components shaped from polyvinyl chloride resin compositions WITCO CORPORATION (US) 1989-09-06 EP disclosed
EP-0038876-B1 2,6-DI-TERTIARY BUTYL PHENYL PENTAERYTHRITOL SPIRO BIS-PHOSPHITES ENHANCING THE STABILITY TO HEAT AND LIGHT OF SYNTHETIC RESINS, STABILIZER COMPOSITIONS COMPRISING PHENOLIC ANTIOXIDANTS AND SUCH PHOSPHITES, AND SYNTHETIC RESIN COMPOSITIONS CONTAINING THE SAME ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1984-10-10 EP disclosed
US-4219463-A Stabilizers for synthetic polymers comprising 2,2,6,6-tetramethyl-4-piperidyl carboxylic acid ester, β-thioalkyl propionic acid ester and phenol ARGUS CHEMICAL CORPORATION (US) 1980-08-26 US disclosed
US-4080364-A Stabilization of polyolefins against degradative deterioration as a result of exposure to light and air at elevated temperatures ARGUS CHEMICAL CORPORATION (US) 1978-03-21 US disclosed
US-3997551-A OXIDATION RESISTANCE, STABILIZE POLYMERS ARGUS CHEMICAL CORPORATION (US) 1976-12-14 US disclosed