SCHEMBL15030906

SCHEMBL15030906

COC(=O)Oc1ccc(CCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)cc1CO

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.35
MTNR1B P49286 3/20 0.35
ALDH1A1 P00352 3/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
PLAAT3 P53816 1/20 0.34
PLAAT5 Q96KN8 1/20 0.34
PLAAT2 Q9NWW9 1/20 0.34
PLAAT4 Q9UL19 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL15030908 0.88 MTNR1A (0.44) MTNR1AMTNR1BALDH1A1CA12CA1
SCHEMBL15832121 0.82 MEN1 (0.35) MTNR1AMTNR1BALDH1A1HPGD
SCHEMBL11949446 0.82 MTNR1A (0.47) MTNR1AMTNR1BALDH1A1CA12CA1
SCHEMBL12451841 0.81 HPGD (0.34) MTNR1AMTNR1BALDH1A1HPGD
SCHEMBL15893580 0.80 ALDH1A1 (0.39) MTNR1AMTNR1BALDH1A1CA12CA1
SCHEMBL13898217 0.80 MTNR1A (0.44) MTNR1AMTNR1BALDH1A1CA12CA1
SCHEMBL12451840 0.79 ALOX5AP (0.34) MTNR1AMTNR1BALDH1A1PLAAT3PLAAT5
SCHEMBL13612909 0.78 CA12 (0.50) MTNR1AMTNR1BALDH1A1CA12CA1
SCHEMBL12451786 0.78 MEN1 (0.34) MTNR1AMTNR1BALDH1A1PLAAT3PLAAT5
SCHEMBL12364504 0.77 PTGS1 (0.50) MTNR1AMTNR1BALDH1A1CA12CA1

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-8465892-B2 Chemically resistive and lubricated overcoat XEROX CORPORATION (US) 2013-06-18 US disclosed