SCHEMBL3157771

SCHEMBL3157771

COc1c(C(C)(C)C)cc(O)cc1C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
CA2 P00918 4/20 0.50
CYP3A4 P08684 2/20 0.50
MAPT P10636 2/20 0.50
CA1 P00915 2/20 0.50
ALOX15 P16050 3/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 1/20 0.47
HPGD P15428 1/20 0.47
ALDH1A1 P00352 5/20 0.46
TYR P14679 2/20 0.46
NR1I2 O75469 1/20 0.46
CYP2C9 P11712 1/20 0.46
MIF P14174 1/20 0.46
HTT P42858 1/20 0.46
NFE2L2 Q16236 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PTGS2 P35354 4/20 0.46
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL23321603 0.87 TDP1 (0.45) TDP1CA2CYP3A4MAPTCA1
SCHEMBL22360314 0.78 CA1 (0.64) TDP1CA2CYP3A4CA1ALOX15
SCHEMBL2947022 0.78 PTGS2 (0.47) TDP1CA2CYP3A4MAPTCA1
SCHEMBL5857102 0.78 ALDH1A1 (0.52) TDP1CA2CYP3A4CA1ALOX15
SCHEMBL8807107 0.77 ALDH1A1 (0.39) TDP1CA2CYP3A4MAPTCA1
SCHEMBL6668536 0.76 PTGS2 (0.46) TDP1CA2CYP3A4MAPTCA1
SCHEMBL11743999 0.76 PTGS2 (0.46) TDP1CA2CYP3A4MAPTCA1
SCHEMBL1304740 0.76 PTGS2 (0.50) TDP1CA2CYP3A4MAPTCA1
SCHEMBL15063256 0.76 PTGS2 (0.46) TDP1CA2CYP3A4MAPTCA1
SCHEMBL6062560 0.76 PTGS2 (0.46) TDP1CA2CYP3A4MAPTCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115433236-A Carbene catalyst, poly cyclopentenyl special elastomer, and preparation method and application thereof 北京石油化工学院 2022-12-06 CN claimed
EP-2532632-B1 Inhibitor combination, resin mixture containing same and use of same HILTI AG (LI) 2017-08-16 EP claimed
US-9523001-B2 Silicone rubber composition TERUMO KABUSHIKI KAISHA (JP) 2016-12-20 US claimed
US-20140224424-A1 INHIBITOR COMBINATION, RESIN MIXTURE CONTAINING SAME AND USE OF SAME HILTI AKTIENGESELLSCHAFT (LI) 2014-08-14 US claimed
US-8735475-B2 Inhibitor combination, resin mixture containing same and use of same HILTI AKTIENGESELLSCHAFT (LI) 2014-05-27 US claimed
US-20130192167-A1 SILICONE RUBBER COMPOSITION TERUMO KABUSHIKI KAISHA (JP) 2013-08-01 US claimed
US-20130123393-A1 INHIBITOR COMBINATION, RESIN MIXTURE CONTAINING SAME AND USE OF SAME HILTI AKTIENGESELLSCHAFT (LI) 2013-05-16 US claimed
EP-2532632-A2 Inhibitor combination, resin mixture containing same and use of same HILTI Aktiengesellschaft (LI) 2012-12-12 EP claimed
US-20060149017-A1 Novel thermoplastic hydrogel polymer cmpositions for use in producing contact lenses and methods of proucing said compositions OCUTEC LIMITED (GB) 2006-07-06 US claimed
US-5082885-A Phenolic compound SHELL OIL COMPANY (US) 1992-01-21 US claimed
EP-0104125-B1 5,2',3',4',4\",6\"-HEXADEOXYKANAMYCIN AND ITS 1-N-ACYLATED DERIVATIVE ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1986-12-30 EP claimed
US-4486419-A BACTERICIDAL ANTIBIOTICS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-12-04 US claimed
EP-0108714-A1 Dibenzodioxaphosphepine and dioxaphosphocine processing stabilizers CIBA-GEIGY AG (CH) 1984-05-16 EP claimed
EP-0104125-A1 5,2',3',4',4\",6\"-Hexadeoxykanamycin and its 1-N-acylated derivative ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-03-28 EP claimed
US-12358210-B2 Resin composition for stereolithography KURARAY NORITAKE DENTAL INC. (JP) 2025-07-15 US disclosed
US-20230096105-A1 RESIN COMPOSITION FOR STEREOLITHOGRAPHY KURARAY NORITAKE DENTAL INC. (JP) 2023-03-30 US disclosed
EP-4116339-A1 RESIN COMPOSITION FOR STEREOLITHOGRAPHY Kuraray Noritake Dental Inc. (JP) 2023-01-11 EP disclosed
EP-0104125-A1 5,2',3',4',4\",6\"-Hexadeoxykanamycin and its 1-N-acylated derivative ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-03-28 EP disclosed
US-4374219-A STABILIZERS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1983-02-15 US disclosed
US-4318845-A STABILIZERS CIBA-GEIGY CORPORATION (US) 1982-03-09 US disclosed