SCHEMBL2841753

SCHEMBL2841753

CCCCN(CCO)c1nc(N(CCO)CCCC)nc(N(CCO)CCCC)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 16/20 0.57
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CRHR1 P34998 3/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
PDE2A O00408 1/20 0.40
RGS12 O14924 1/20 0.40
SLC22A2 O15244 1/20 0.40
SLC22A1 O15245 1/20 0.40
ABCC4 O15439 1/20 0.40
ABCC5 O15440 1/20 0.40
PDE6D O43924 1/20 0.40
PDE8A O60658 1/20 0.40
GMNN O75496 1/20 0.40
USP2 O75604 1/20 0.40
PDE5A O76074 1/20 0.40
ABCB11 O95342 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL2844587 0.92 SLC29A1 (0.57) SLC29A1MAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL11668653 0.91 SLC29A1 (0.50) SLC29A1MAPTSMN1; SMN2CRHR1KDM4E
SCHEMBL2838653 0.91 SLC29A1 (0.54) SLC29A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL5355585 0.89 MAPT (0.50) SLC29A1MAPTSMN1; SMN2CRHR1MEN1
SCHEMBL660741 0.85 SLC29A1 (0.44) SLC29A1MAPTSMN1; SMN2CRHR1MEN1
SCHEMBL125327 0.84 SLC29A1 (0.42) SLC29A1MAPTSMN1; SMN2CRHR1MEN1
SCHEMBL21081373 0.84 MAPT (0.47) SLC29A1MAPTSMN1; SMN2CRHR1MEN1
SCHEMBL2835526 0.84 SLC29A1 (0.54) SLC29A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL1035062 0.83 SLC29A1 (0.58) SLC29A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL11766019 0.82 SLC29A1 (0.68) SLC29A1MAPTSMN1; SMN2KDM4EMEN1

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
WO-2010066686-A2 NOVEL TRIAZINE POLYMERS, METHOD FOR THE PRODUCTION AND USE THEREOF BOREALIS AGROLINZ MELAMINE GMBH (AT) 2010-06-17 WO claimed
WO-2010066686-A2 NOVEL TRIAZINE POLYMERS, METHOD FOR THE PRODUCTION AND USE THEREOF BOREALIS AGROLINZ MELAMINE GMBH (AT) 2010-06-17 WO disclosed