SCHEMBL28845477

SCHEMBL28845477

O=C(O)N1CCCCC(CO)C1=O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
ACE P12821 6/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
BBOX1 O75936 1/20 0.33
ASPH Q12797 1/20 0.33
KDM8 Q8N371 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
HIF1AN Q9NWT6 1/20 0.33
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL23001009 0.79 ACE (0.41) ALDH1A1ACE
SCHEMBL542160 0.74 ALDH1A1 (0.41) ALDH1A1ACESMN1; SMN2BBOX1ASPH
SCHEMBL28055445 0.73 ACE (0.39) ALDH1A1ACEPOLBL3MBTL1
SCHEMBL11025704 0.72 ACE (0.47) ACESMN1; SMN2TDP1POLBL3MBTL1
SCHEMBL11025701 0.71 ACE (0.61) ACE
SCHEMBL3226035 0.70 ACE (0.39) ACE
SCHEMBL7146602 0.69 L3MBTL1 (0.37) ALDH1A1ACESMN1; SMN2L3MBTL1
SCHEMBL28017368 0.69 ACE (0.38) ACE
SCHEMBL6204538 0.69 NOS3 (0.39) ALDH1A1ACESMN1; SMN2LMNA
SCHEMBL16609893 0.68 ACE (0.38) ALDH1A1ACESMN1; SMN2TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104302643-B Plant growth regulating compound 先正达参股股份有限公司 2017-08-25 CN disclosed