SCHEMBL2881228

SCHEMBL2881228

C=CC(=O)OCC1(CCC)CCCO1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.39
HPGD P15428 1/20 0.39
ALDH1A1 P00352 3/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 1/20 0.32
THRB P10828 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
SCHEMBL2878357 0.92 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL2884001 0.90 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL3290006 0.83 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2885199 0.82 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2885352 0.81 TSHR (0.38) TSHRALDH1A1THRB
SCHEMBL1357293 0.79 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9746084 0.78 ALDH1A1 (0.33) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2883242 0.76 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2885251 0.75 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL15545863 0.75 TSHR (0.50) TSHRHPGDALDH1A1TP53HIF1A

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-7759451-B2 Fumaric diester copolymer TOSOH CORPORATION (JP) 2010-07-20 US disclosed
US-20070298247-A1 Fumaric diester copolymer TOSOH CORPORATION (JP) 2007-12-27 US disclosed