SCHEMBL10989774

SCHEMBL10989774

C=CCC(C(=O)C(CC=C)[Si](C)(C)C)[Si](C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.32
GRIK2 Q13002 2/20 0.32
CYP2C19 P33261 1/20 0.31
CPA1 P15085 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
SCHEMBL8617632 0.84 GRIK1 (0.39) GRIK1GRIK2CYP2C19CPA1
SCHEMBL7905059 0.67 GRIK1 (0.34) GRIK1GRIK2CYP2C19CPA1
SCHEMBL2527358 0.67 GRIK1 (0.35) GRIK1GRIK2CYP2C19CPA1
SCHEMBL29012642 0.67
SCHEMBL4558473 0.64
SCHEMBL30025726 0.64
SCHEMBL8461298 0.63 GRIK1 (0.33) GRIK1GRIK2CYP2C19CPA1
SCHEMBL5377593 0.63 GRIK1 (0.42) GRIK1GRIK2CYP2C19CPA1
SCHEMBL10989780 0.63
SCHEMBL28871062 0.63 TSHR (0.32)

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-4536336-A New anthracyclinones and their production MEIJI SEIKA KAISHA, LTD. (JP) 1985-08-20 US disclosed
EP-0114001-A1 New anthracyclinones and their production MEIJI SEIKA KAISHA LTD. (JP) 1984-07-25 EP disclosed