SCHEMBL6315629

SCHEMBL6315629

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

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 6/20 0.52
KMT2A Q03164 3/20 0.40
TGM2 P21980 2/20 0.40
DNMT3A Q9Y6K1 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
LMNA P02545 1/20 0.38
STAT6 P42226 1/20 0.38

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
SCHEMBL6316254 0.82 ASAH1 (0.54) ASAH1KMT2ADNMT3ASMN1; SMN2NPC1
SCHEMBL432106 0.80 EGLN3 (0.53) ASAH1SMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL7790594 0.76 ASAH1 (0.51) ASAH1KMT2ADNMT3ASMN1; SMN2NPC1
SCHEMBL13092515 0.74 ASAH1 (0.66) ASAH1KMT2ASMN1; SMN2NPC1ALDH1A1
SCHEMBL17309678 0.74 ASAH1 (0.47) ASAH1KMT2ADNMT3ASMN1; SMN2NPC1
SCHEMBL13092517 0.74 ASAH1 (0.66) ASAH1KMT2ASMN1; SMN2NPC1ALDH1A1
SCHEMBL29182109 0.72 KMT2A (0.53) ASAH1KMT2ADNMT3ASMN1; SMN2NPC1
SCHEMBL10504076 0.72 ASAH1 (0.50) ASAH1KMT2ADNMT3ASMN1; SMN2NPC1
SCHEMBL17322551 0.72 EGLN3 (0.51) ASAH1KMT2ADNMT3ASMN1; SMN2NPC1
SCHEMBL7106200 0.71 ASAH1 (0.64) ASAH1KMT2ADNMT3ASMN1; SMN2NPC1

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-1303566-A1 SUPERPARAMAGNETIC PEARL POLYMERS Bayer Aktiengesellschaft (DE) 2003-04-23 EP disclosed
WO-2002004555-A1 SUPERPARAMAGNETIC PEARL POLYMERS BAYER AKTIENGESELLSCHAFT (DE) 2002-01-17 WO disclosed