SCHEMBL7155207

SCHEMBL7155207

CCOC(C)(C)C.COC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 1/20 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
SCHEMBL42870 0.89
SCHEMBL15345893 0.83 ALDH1A1 (0.68) ALDH1A1TSHRTDP1
Alcohol SCHEMBL9788471 0.80 ALDH1A1 (0.40) ALDH1A1TSHRMAPK1
Ether SCHEMBL3135819 0.80 MAPK1 (0.33) ALDH1A1MAPK1
Methylene Chloride SCHEMBL8718698 0.80 MAPK1 (0.33) ALDH1A1MAPK1
Ethylene Glycol SCHEMBL28175590 0.79 MAPK1 (0.35) ALDH1A1MAPK1
SCHEMBL5487582 0.79 ALDH1A1 (0.61) ALDH1A1TSHRTDP1
Ethylene Glycol SCHEMBL5414516 0.78 MAPK1 (0.38) ALDH1A1TSHRMAPK1
Ether SCHEMBL11858 0.76 ALDH1A1 (0.57) ALDH1A1TSHRTDP1
Acetic Acid SCHEMBL9771962 0.75 FFAR3 (0.41) ALDH1A1TSHRTDP1MAPK1

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
EP-0899291-B1 CURABLE COMPOSITION, FOAM MADE BY USING THE SAME, AND PROCESS FOR THE PRODUCTION THEREOF KANEKA CORP (JP) 2003-08-13 EP disclosed
US-6031012-A Curable composition, foam produced therefrom, and process for producing the foam KANEKA CORPORATION (JP) 2000-02-29 US disclosed
EP-0899291-A1 CURABLE COMPOSITION, FOAM MADE BY USING THE SAME, AND PROCESS FOR THE PRODUCTION THEREOF KANEKA CORPORATION (JP) 1999-03-03 EP disclosed