SCHEMBL14111167

SCHEMBL14111167

C=C(C)C(=O)NCCNCCC[Si](OCC)(OCC)OCC

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PAOX Q6QHF9 1/20 0.34
▸ CA3 P07451 1/20 0.31
▸ CA5A P35218 1/20 0.31
▸ CA5B Q9Y2D0 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ THRB P10828 1/20 0.30

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
SCHEMBL79938 0.91 ACHE (0.34) PAOXKDM4ETHRB
SCHEMBL29043134 0.86 KDM4E (0.35) PAOXKDM4ETHRB
SCHEMBL25387831 0.84 KDM4E (0.38) PAOXKDM4E
SCHEMBL25390690 0.84 KDM4E (0.38) PAOXKDM4E
SCHEMBL23031410 0.84 KDM4E (0.38) PAOXKDM4E
SCHEMBL360110 0.84 PAOX (0.33) PAOXCA3CA5ACA5BKDM4E
SCHEMBL29440665 0.84 THRB (0.35) THRB
SCHEMBL23036035 0.83 ACHE (0.32) THRB
SCHEMBL4630559 0.83 PAOX (0.35) PAOXCA3CA5ACA5BKDM4E
SCHEMBL16754905 0.83 ACHE (0.32) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080182936-A1 POLYMER FOR AN INK RECEIVING LAYER OF AN INKJET RECORDING ELEMENT HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2008-07-31 — — US disclosed
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