SCHEMBL7192029

SCHEMBL7192029

C=C(C)C(CCC)OC(CCC)C(=C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL15828887 0.82
SCHEMBL1576259 0.79
SCHEMBL855258 0.79 CHRM1 (0.35) TSHR
SCHEMBL7195337 0.78 TSHR (0.36) TSHR
SCHEMBL8039993 0.77 TSHR (0.31) TSHR
SCHEMBL1576798 0.75
SCHEMBL6272664 0.73 MEN1 (0.31)
SCHEMBL6271182 0.73 MEN1 (0.31)
SCHEMBL1576749 0.73 SMN1; SMN2 (0.31)
SCHEMBL446541 0.70 CHRM1 (0.55) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3743454-A1 CURABLE COMPOSITION COMPRISING AN ACETAL PLASTICIZER SIKA TECHNOLOGY AG (CH) 2020-12-02 EP disclosed
WO-2019145420-A1 CURABLE COMPOSITION COMPRISING AN ACETAL PLASTICIZER SIKA TECHNOLOGY AG (CH) 2019-08-01 WO disclosed
EP-1092700-B1 Process for the preparation of unsaturated 4,5-allene ketones, 3,5-dienketones and the corresponding saturated ketones DEGUSSA (DE) 2003-10-22 EP disclosed
EP-1092700-A1 Process for the preparation of unsaturated 4,5-allene ketones, 3,5-dienketones and the corresponding saturated ketones Degussa-Hüls Aktiengesellschaft (DE) 2001-04-18 EP disclosed
EP-0897380-A1 METHOD FOR THE PRODUCTION OF $g(g), $g(d)-UNSATURATED KETONES BY REACTING TERTIARY ALLYL ALCOHOLS WITH ALKENYL ALKYL ETHERS BASF AKTIENGESELLSCHAFT (DE) 1999-02-24 EP disclosed
WO-1998023570-A1 METHOD FOR THE PRODUCTION OF η, δ-UNSATURATED KETONES BY REACTING TERTIARY ALLYL ALCOHOLS WITH ALKENYL ALKYL ETHERS BASF AKTIENGESELLSCHAFT (DE) 1998-06-04 WO disclosed
US-5068382-A PROCESS FOR THE PRODUCTION OF ORGANOSILICON COMPOUNDS HUELS AKTIENGESELLSCHAFT (DE) 1991-11-26 US disclosed