SCHEMBL7155205

SCHEMBL7155205

CC(C)(C)COCC(C)(C)C.CC(OC(C)C(C)(C)C)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 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
SCHEMBL478333 0.82 ALDH1A1 (0.31)
SCHEMBL18191 0.78 CYP2C19 (0.42) CYP2C19
Isopropyl Alcohol SCHEMBL20235927 0.77 ALDH1A1 (0.38) CYP2C19
Isopropylamine SCHEMBL8865306 0.77 CYP2C19 (0.33) CYP2C19
SCHEMBL28557000 0.75 CYP2C19 (0.40) CYP2C19
Hydrochloric Acid SCHEMBL8858515 0.75 CYP2C19 (0.40) CYP2C19
SCHEMBL15277623 0.74 ACHE (0.32) CYP2C19
Chloroform SCHEMBL4544169 0.73 CYP2C19 (0.35) CYP2C19
SCHEMBL12039837 0.72 CYP2C19 (0.31) CYP2C19
Di(Hydroxyethyl)Ether SCHEMBL19856403 0.72 TSHR (0.48)

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