SCHEMBL2883648

SCHEMBL2883648

C=C(C)C(=O)OCC1(C(C)C)COC1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
ALDH1A1 P00352 2/20 0.41
THRB P10828 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
SCHEMBL2880897 0.86 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL2885471 0.84 TSHR (0.43) TSHRALDH1A1THRB
SCHEMBL11149065 0.79 TSHR (0.48) TSHRALDH1A1THRB
SCHEMBL2877581 0.78 TSHR (0.47) TSHRALDH1A1THRB
SCHEMBL154821 0.77 ALDH1A1 (0.44) TSHRALDH1A1THRB
SCHEMBL2883056 0.77 TSHR (0.46) TSHRALDH1A1THRB
SCHEMBL156498 0.75 ALDH1A1 (0.42) TSHRALDH1A1THRB
SCHEMBL2880702 0.75 ALDH1A1 (0.42) TSHRALDH1A1THRB
SCHEMBL11145292 0.75 TSHR (0.52) TSHRALDH1A1THRB
SCHEMBL2880778 0.74 THRB (0.41) TSHRALDH1A1THRB

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