SCHEMBL1899338

SCHEMBL1899338

CC(C)CCC(C)Nc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
CYP3A4 P08684 4/20 0.58
ALOX15 P16050 3/20 0.58
TSHR P16473 3/20 0.58
HSD17B10 Q99714 3/20 0.58
ALOX12 P18054 2/20 0.58
HIF1A Q16665 2/20 0.58
MAPK1 P28482 1/20 0.58
TDP1 Q9NUW8 3/20 0.54
THRB P10828 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 2/20 0.47
RECQL P46063 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
HSP90AA1 P07900 1/20 0.46
CASP1 P29466 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL201628 0.92 ALDH1A1 (0.71) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL39071 0.89 ALDH1A1 (0.58) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL258893 0.85 MAPT (0.45) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL861952 0.84 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL19265914 0.83 TDP1 (0.54) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1454381 0.83 TDP1 (0.54) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL9468080 0.81 ALDH1A1 (0.67) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1829563 0.81 ALOX15 (0.49) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL11203732 0.81 ALOX15 (0.49) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL29734967 0.81 ALOX15 (0.49) ALDH1A1CYP3A4ALOX15TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1843995-B1 MEANS FOR CONTROLLING THE EXOTHERMIC REACTION OF STYRENIC MONOMERS WITH SULFONIC ACIDS CHEMTURA CORP (US) 2013-06-05 EP claimed
US-8013083-B2 Means for controlling the exothermic reaction of styrenic monomers with sulfonic acids CHEMTURA CORPORATION (US) 2011-09-06 US claimed
JP-4686550-B2 2011-05-25 JP claimed
EP-1843995-A1 MEANS FOR CONTROLLING THE EXOTHERMIC REACTION OF STYRENIC MONOMERS WITH SULFONIC ACIDS Chemtura Corporation (US) 2007-10-17 EP claimed
WO-2006083923-A1 MEANS FOR CONTROLLING THE EXOTHERMIC REACTION OF STYRENIC MONOMERS WITH SULFONIC ACIDS CHEMTURA CORPORATION (US) 2006-08-10 WO claimed
US-20060178489-A1 Means for controlling the exothermic reaction of styrenic monomers with sulfonic acids ADDIVANT USA, LLC 2006-08-10 US claimed
CN-113683578-B Preparation method of 2,4, 6-tri (N-1, 4-dimethyl amyl p-phenylenediamine) -1,3, 5-triazine 山东阳谷华泰化工股份有限公司 2022-12-09 CN disclosed
EP-1843995-B1 MEANS FOR CONTROLLING THE EXOTHERMIC REACTION OF STYRENIC MONOMERS WITH SULFONIC ACIDS CHEMTURA CORP (US) 2013-06-05 EP disclosed
US-8013083-B2 Means for controlling the exothermic reaction of styrenic monomers with sulfonic acids CHEMTURA CORPORATION (US) 2011-09-06 US disclosed
EP-1843995-A1 MEANS FOR CONTROLLING THE EXOTHERMIC REACTION OF STYRENIC MONOMERS WITH SULFONIC ACIDS Chemtura Corporation (US) 2007-10-17 EP disclosed
WO-2006083923-A1 MEANS FOR CONTROLLING THE EXOTHERMIC REACTION OF STYRENIC MONOMERS WITH SULFONIC ACIDS CHEMTURA CORPORATION (US) 2006-08-10 WO disclosed
US-20060178489-A1 Means for controlling the exothermic reaction of styrenic monomers with sulfonic acids ADDIVANT USA, LLC 2006-08-10 US disclosed