SCHEMBL11653904

SCHEMBL11653904

C=CC(=O)OCCOc1cc(C(C)(C)CC)c(O)c(C(C)(C)CC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 4/20 0.50
▸ TSHR P16473 6/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.39
▸ TP53 P04637 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CYP3A4 P08684 1/20 0.36
▸ GAA P10253 1/20 0.34
▸ CNR1 P21554 4/20 0.33
▸ CNR2 P34972 4/20 0.33
▸ TRPV1 Q8NER1 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MAPK1 P28482 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ ALOX5 P09917 1/20 0.31

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
SCHEMBL11648518 0.88 THRB (0.49) THRBTSHRHPGDALDH1A1TP53
SCHEMBL11651650 0.88 THRB (0.54) THRBTSHRHPGDALDH1A1TP53
SCHEMBL11655315 0.84 TSHR (0.50) THRBTSHRHPGDALDH1A1TP53
SCHEMBL11654442 0.82 THRB (0.48) THRBTSHRHPGDALDH1A1TP53
SCHEMBL11655697 0.82 THRB (0.42) THRBTSHRALDH1A1MEN1KMT2A
SCHEMBL11797744 0.80 CA1 (0.44) THRBTSHRALDH1A1HIF1ACYP3A4
SCHEMBL10314172 0.78 THRB (0.63) THRBTSHRHPGDALDH1A1TP53
SCHEMBL12752304 0.78 THRB (0.71) THRBTSHRHPGDALDH1A1TP53
SCHEMBL5405672 0.74 GAA (0.45) THRBTSHRHPGDALDH1A1TP53
SCHEMBL15339018 0.74 THRB (0.65) THRBTSHRHPGDALDH1A1TP53

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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