SCHEMBL11654751

SCHEMBL11654751

C=C(C)C(=O)OCCOCc1cc(C(C)(C)CC(C)C)c(O)c(C(C)(C)CC(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.40
▸ TSHR P16473 3/20 0.36
▸ SERPINE1 P05121 1/20 0.31
▸ HMGCR P04035 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ APEX1 P27695 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL11652439 0.87 THRB (0.47) THRBTSHRSERPINE1POLBAPEX1
SCHEMBL11649063 0.86 THRB (0.42) THRBTSHRHMGCRPOLBAPEX1
SCHEMBL11648354 0.86 THRB (0.42) THRBTSHRPOLBAPEX1HTT
SCHEMBL11298132 0.85 THRB (0.46) THRBTSHRHMGCRHTTTDP1
SCHEMBL11650097 0.85 THRB (0.44) THRBTSHRPOLBAPEX1HTT
SCHEMBL11667997 0.84 THRB (0.45) THRBTSHRHMGCRHTTTDP1
SCHEMBL11646076 0.84 THRB (0.45) THRBTSHRHMGCRHTTTDP1
SCHEMBL11653096 0.83 POLB (0.39) THRBTSHRPOLBAPEX1HTT
SCHEMBL11648861 0.83 THRB (0.43) THRBTSHRPOLBAPEX1HTT
SCHEMBL18124228 0.73 GAA (0.48) THRBTSHRHMGCRHTTTDP1

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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