SCHEMBL2885571

SCHEMBL2885571

C=C(C)C(=O)OC(C)C1(CC(C)C)COC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
ALDH1A1 P00352 2/20 0.33

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
SCHEMBL756702 0.86 TSHR (0.37) TSHRALDH1A1
SCHEMBL2882857 0.83 TSHR (0.35) TSHRALDH1A1
SCHEMBL2880738 0.81 TSHR (0.37) TSHRALDH1A1
SCHEMBL2884047 0.78 TSHR (0.40) TSHR
SCHEMBL2881284 0.77 TSHR (0.36) TSHRALDH1A1
SCHEMBL2885470 0.76 TSHR (0.35) TSHRALDH1A1
SCHEMBL2880775 0.74 TSHR (0.35) TSHRALDH1A1
SCHEMBL2882330 0.73 TSHR (0.33) TSHRALDH1A1
SCHEMBL2877581 0.72 TSHR (0.47) TSHRALDH1A1
SCHEMBL2883648 0.71 TSHR (0.46) TSHRALDH1A1

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