SCHEMBL6708535

SCHEMBL6708535

CCO[Si](C)(OCC)C(CC)N(c1ccc(N)cc1)C(CC)[Si](C)(OCC)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.40
CYP3A4 P08684 4/20 0.40
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PSMD14 O00487 1/20 0.40
RECQL P46063 1/20 0.40
GFER P55789 1/20 0.40
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
CYP1A2 P05177 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 1/20 0.32
MAOA P21397 1/20 0.32
PKM P14618 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
SCHEMBL6708548 0.87 TDP1 (0.40) TDP1CYP3A4ALDH1A1TSHRMAPK1
SCHEMBL6706779 0.85 TDP1 (0.41) TDP1CYP3A4ALDH1A1TSHRMAPK1
SCHEMBL6706847 0.83 TDP1 (0.40) TDP1CYP3A4ALDH1A1TSHRMAPK1
SCHEMBL6707411 0.78 TDP1 (0.41) TDP1CYP3A4ALDH1A1TSHRMAPK1
SCHEMBL107809 0.69 TDP1 (0.50) TDP1CYP3A4ALDH1A1TSHRMAPK1
SCHEMBL3595180 0.67
SCHEMBL3449604 0.65
SCHEMBL16389981 0.65
SCHEMBL1979093 0.65 CYP3A4 (0.50) TDP1CYP3A4ALDH1A1TSHRMAPK1
SCHEMBL16389841 0.65

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-20040028978-A1 Proton conducting membrane, method for producing the same, and fuel cell using the same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2004-02-12 US disclosed
EP-1334993-A2 Proton conducting membrane, method for producing the same, and fuel cell using the same National Institute of Advanced Industrial Science and Technology (JP) 2003-08-13 EP disclosed