SCHEMBL7115309

SCHEMBL7115309

CC[N+](CC)(CC)CCCOCCC[N+](CC)(CC)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.50
TSHR P16473 3/20 0.39
NFKB1 P19838 1/20 0.39
KCNA1 Q09470 1/20 0.39
SLC22A1 O15245 3/20 0.38
SLC22A2 O15244 1/20 0.38
KDM4E B2RXH2 1/20 0.37
PMP22 Q01453 1/20 0.37
ATM Q13315 1/20 0.37
CHRNB2 P17787 2/20 0.37
CHRNB4 P30926 2/20 0.37
CHRNA3 P32297 2/20 0.37
CHRNA7 P36544 2/20 0.37
CHRNA4 P43681 2/20 0.37
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
Water SCHEMBL15226612 0.87 DNM1 (0.44) DNM1TSHRNFKB1KCNA1SLC22A1
Hydrochloric Acid SCHEMBL116796 0.86 DNM1 (0.62) DNM1TSHRSLC22A1SLC22A2ALDH1A1
SCHEMBL8057202 0.81 CHRNA7 (0.44) DNM1TSHRNFKB1KCNA1KDM4E
SCHEMBL16352866 0.81 DNM1 (0.50) DNM1TSHRSLC22A1SLC22A2CHRNB2
SCHEMBL12560598 0.79 CHRNA7 (0.43) DNM1TSHRNFKB1KCNA1KDM4E
SCHEMBL24465404 0.78 DNM1 (0.58) DNM1TSHRSLC22A1SLC22A2ALDH1A1
SCHEMBL6577401 0.77 DNM1 (0.65) DNM1TSHRNFKB1KCNA1SLC22A1
SCHEMBL29548110 0.77 DNM1 (0.75) DNM1TSHRNFKB1KCNA1SLC22A1
SCHEMBL20543368 0.77 CYP3A4 (0.35) DNM1TSHRALDH1A1CYP3A4SMN1; SMN2
SCHEMBL20543209 0.77 CYP3A4 (0.35) DNM1TSHRALDH1A1CYP3A4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0928809-B1 POLYSACCHARIDE DERIVATIVE/MAGNETIC METAL OXIDE COMPOSITE MEITO SANGYO KK (JP) 2003-10-22 EP disclosed
US-6165378-A Polysaccharide derivative/magnetic metal oxide composite MEITO SANGYO KABUSHIKI KAISHA (JP) 2000-12-26 US disclosed
EP-0928809-A1 POLYSACCHARIDE DERIVATIVE/MAGNETIC METAL OXIDE COMPOSITE MEITO SANGYO KABUSHIKI KAISHA (JP) 1999-07-14 EP disclosed