SCHEMBL6706779

SCHEMBL6706779

CCC(N(c1ccc(N)cc1)C(CC)[Si](C)(OC)OC)[Si](C)(OC)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.41
ALDH1A1 P00352 5/20 0.41
CYP3A4 P08684 4/20 0.41
MAPK1 P28482 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TSHR P16473 2/20 0.41
PSMD14 O00487 1/20 0.41
RECQL P46063 1/20 0.41
GFER P55789 1/20 0.41
TP53 P04637 2/20 0.36
ALOX15 P16050 1/20 0.36
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PKM P14618 1/20 0.31
NPC1 O15118 1/20 0.30
HPGD P15428 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
SCHEMBL6707411 0.86 TDP1 (0.41) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL6708535 0.85 TDP1 (0.40) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL6708548 0.78 TDP1 (0.40) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL6706847 0.75 TDP1 (0.40) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL6707439 0.71 TDP1 (0.40) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL107809 0.70 TDP1 (0.50) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL8029180 0.67 TDP1 (0.42) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL2244059 0.66
SCHEMBL8629718 0.66 TDP1 (0.45) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL10815154 0.64 TDP1 (0.50) TDP1ALDH1A1CYP3A4MAPK1L3MBTL1

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