SCHEMBL17486715

SCHEMBL17486715

C[Si]1(CCCOCC2CO2)CCCCO[Si](C)(CCCOCCCOCCC[Si]2(C)CCCCO[Si](C)(CCCOCC3CO3)O2)O1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPK1 P28482 1/20 0.32

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
SCHEMBL16923023 0.95 TSHR (0.40) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL642391 0.86 TSHR (0.53) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL16923019 0.85 TSHR (0.35) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL16923025 0.84 TSHR (0.35) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL14826035 0.77 TSHR (0.34) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL16661604 0.75 TSHR (0.61) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL2066081 0.75 TSHR (0.61) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL18371651 0.75 TSHR (0.61) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL2006386 0.75 TSHR (0.61) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL18472006 0.74 EPHX2 (0.32) SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180036490-A1 GASKET SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2018-02-08 US disclosed
US-20170037212-A1 METHOD FOR MODIFYING SURFACE AND SURFACE MODIFIED ELASTIC BODY SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2017-02-09 US disclosed
US-20160033042-A1 GASKET SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2016-02-04 US disclosed