SCHEMBL11657130

SCHEMBL11657130

C=C(C)C(=O)OCCOCCCCCCCCCCCCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 7/20 0.45
▸ THRB P10828 1/20 0.42
▸ TSHR P16473 4/20 0.41
▸ KMT2A Q03164 4/20 0.39
▸ HTT P42858 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ PKM P14618 1/20 0.37
▸ MEN1 O00255 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ USP2 O75604 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ HIF1A Q16665 1/20 0.36

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
SCHEMBL11650422 1.00 GAA (0.45) GAATHRBTSHRKMT2AHTT
SCHEMBL10548922 0.89 GAA (0.50) GAATHRBTSHRKMT2AHTT
SCHEMBL11646076 0.86 THRB (0.45) GAATHRBTSHRKMT2AHTT
SCHEMBL11667997 0.86 THRB (0.45) GAATHRBTSHRKMT2AHTT
SCHEMBL18124228 0.86 GAA (0.48) GAATHRBTSHRKMT2AHTT
SCHEMBL11650842 0.85 GAA (0.48) GAATSHRKMT2AHTTTDP1
SCHEMBL11298132 0.85 THRB (0.46) GAATHRBTSHRKMT2AHTT
SCHEMBL11668133 0.81 GAA (0.55) GAATHRBTSHRKMT2AHTT
SCHEMBL17548966 0.81 GAA (0.50) GAATHRBTSHRKMT2AHTT
SCHEMBL11654877 0.81 THRB (0.45) GAATHRBTSHRKMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4117240-A CONTAINING ANTIOXIDANT PHENOLIC DERIVATIVES OF ACRYLIC ESTERS AS MONOMERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-09-26 — — US disclosed
US-3962187-A STABILIZED POLYMERS OF DITERTIARY ALKYL-4-HYDROXYBENZYLOXY ALKYL ACRYLATES AND DIENES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-06-08 — — US disclosed
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