SCHEMBL16634377

SCHEMBL16634377

C[Si](C)(CCCNCCN1CCOCC1)O[Si](C)(C)CCCNCCN1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.46
TDP1 Q9NUW8 1/20 0.43
KDM1A O60341 2/20 0.43
HPGD P15428 1/20 0.42
DUSP3 P51452 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2D6 P10635 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 1/20 0.41
ACE2 Q9BYF1 1/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.38

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
SCHEMBL31687256 0.83 TDP1 (0.43) PAOXTDP1KDM1AHPGDDUSP3
SCHEMBL30998792 0.83 TDP1 (0.46) PAOXTDP1KDM1AHPGDDUSP3
SCHEMBL4401738 0.78 CA12 (0.53) PAOXTDP1KDM1AHPGDDUSP3
SCHEMBL13912969 0.78 PAOX (0.51) PAOXKDM1AHPGDDUSP3CA12
SCHEMBL20332798 0.77 TDP1 (0.56) PAOXTDP1KDM1AHPGDDUSP3
SCHEMBL18995662 0.75 PAOX (0.56) PAOXKDM1AHPGDDUSP3CA12
SCHEMBL7326838 0.75 PAOX (0.56) PAOXKDM1AHPGDDUSP3CA12
SCHEMBL14805807 0.75 PAOX (0.49) PAOXTDP1KDM1AHPGDDUSP3
SCHEMBL18513274 0.75 PAOX (0.56) PAOXKDM1AHPGDDUSP3CA12
SCHEMBL26941306 0.75 PAOX (0.56) PAOXKDM1AHPGDDUSP3CA12

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-9427698-B2 Amino-siloxane composition and methods of using the same GENERAL ELECTRIC COMPANY (US) 2016-08-30 US disclosed
US-20150104366-A1 AMINO-SILOXANE COMPOSITION AND METHODS OF USING THE SAME GENERAL ELECTRIC COMPANY (US) 2015-04-16 US disclosed