SCHEMBL3469531

SCHEMBL3469531

CC(C)(C)CC(C)(C)c1ccc(O)cc1.CC(C)(C)c1ccc(O)cc1.CCC(C)(C)c1ccc(O)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.75
LMNA P02545 1/20 0.57
TYR P14679 1/20 0.57
ESR1 P03372 8/20 0.47
ESR2 Q92731 6/20 0.47
CYP3A4 P08684 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ESRRG P62508 3/20 0.42
AR P10275 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
HTR6 P50406 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HSD17B10 Q99714 1/20 0.42
UQCRB P14927 1/20 0.41
CYP2D6 P10635 1/20 0.39
HIF1A Q16665 1/20 0.39
ESRRB O95718 1/20 0.39

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
SCHEMBL7063934 0.93 SHBG (0.88) SHBGLMNATYRESR1ESR2
SCHEMBL6026994 0.91 LMNA (0.70) SHBGLMNATYRESR1ESR2
Formaldehyde SCHEMBL28351070 0.87 SHBG (0.78) SHBGLMNATYRESR1ESR2
SCHEMBL10141 0.87 SHBG (1.00) SHBGLMNATYRESR1ESR2
SCHEMBL31282065 0.87 SHBG (1.00) SHBGLMNATYRESR1ESR2
Formaldehyde SCHEMBL28390588 0.85 LMNA (0.61) SHBGLMNATYRESR1ESR2
Hydrogen Sulfide SCHEMBL10824257 0.85 SHBG (0.95) SHBGLMNATYRESR1ESR2
SCHEMBL22773183 0.85 SHBG (0.95) SHBGLMNATYRESR1ESR2
SCHEMBL10785821 0.85 SHBG (0.95) SHBGLMNATYRESR1ESR2
SCHEMBL28041281 0.85 SHBG (0.95) SHBGLMNATYRESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200109297-A1 ENZYMATIC ANTIMICROBIAL AND ANTIFOULING COATINGS AND POLYMERIC MATERIALS REACTIVE SURFACES, LTD., LLP (US) 2020-04-09 US disclosed
US-10413769-B2 Paint having cell wall particulate material with a protective organophosphorus esterase REACTIVE SURFACES, LTD., LLP (US) 2019-09-17 US disclosed
US-20150328490-A1 BIOLOGICAL ACTIVE COATING COMPONENTS, COATINGS, AND COATED SURFACES REACTIVE SURFACES, LTD., LLP 2015-11-19 US disclosed
US-20140193889-A1 ENZYMATIC ANTIMICROBIAL AND ANTIFOULING COATINGS AND POLYMERIC MATERIALS REACTIVE SURFACES, LTD. (US) 2014-07-10 US disclosed
US-20100248334-A1 Biological active coating components, coatings, and coated surfaces REACTIVE SURFACES, LTD. 2010-09-30 US disclosed
US-20090238811-A1 Enzymatic Antimicrobial and Antifouling Coatings and Polymeric Materials REACTIVE SURFACES LTD. 2009-09-24 US disclosed
US-20040175407-A1 Microorganism coating components, coatings, and coated surfaces REACTIVE SURFACES, LTD. 2004-09-09 US disclosed
US-20040109853-A1 Detoxification surfaces using phosphoric triester hydrolases REACTIVE SURFACES, LTD. 2004-06-10 US disclosed