SCHEMBL6316254

SCHEMBL6316254

C=C(C)C(=O)NCCCC(=O)n1cnc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 6/20 0.54
DNMT3A Q9Y6K1 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALOX15 P16050 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.39

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
SCHEMBL6315629 0.82 ASAH1 (0.52) ASAH1DNMT3ASMN1; SMN2ALDH1A1MAPT
SCHEMBL433632 0.81 EGLN3 (0.52) ASAH1SMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL13092517 0.76 ASAH1 (0.66) ASAH1SMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL13092515 0.76 ASAH1 (0.66) ASAH1SMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL1735988 0.75 ASAH1 (0.55) ASAH1DNMT3ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7790594 0.75 ASAH1 (0.51) ASAH1DNMT3ASMN1; SMN2ALDH1A1MAPT
SCHEMBL10504076 0.74 ASAH1 (0.50) ASAH1DNMT3ASMN1; SMN2ALDH1A1MAPT
SCHEMBL5348211 0.73 SMN1; SMN2 (0.54) ASAH1DNMT3ASMN1; SMN2ALDH1A1MAPT
SCHEMBL17309678 0.73 ASAH1 (0.47) ASAH1DNMT3ASMN1; SMN2ALDH1A1MAPT
SCHEMBL10654951 0.72 ASAH1 (0.90) ASAH1SMN1; SMN2ALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014027-A1 Crosslinked polymer doped with iron oxide; diagnosis of nucleic acids BAYER AKTIENGESELLSCHAFT (DE) 2005-01-20 US claimed
US-20050014027-A1 Crosslinked polymer doped with iron oxide; diagnosis of nucleic acids BAYER AKTIENGESELLSCHAFT (DE) 2005-01-20 US disclosed
EP-1155026-A2 METHOD FOR ISOLATING NUCLEIC ACIDS Bayer Aktiengesellschaft (DE) 2001-11-21 EP disclosed
WO-2000049031-A2 METHOD FOR ISOLATING NUCLEIC ACIDS BAYER AKTIENGESELLSCHAFT (DE) 2000-08-24 WO disclosed