SCHEMBL8429035

SCHEMBL8429035

O=C(CCCCC(=O)OC1CCC=CO1)OC1CCC=CO1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.40
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
BCHE P06276 2/20 0.33
PRKCA P17252 5/20 0.30

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
SCHEMBL11636858 0.87 NAAA (0.38) NAAAUSP2ALDH1A1ALOX15TDP1
SCHEMBL11508632 0.85 TSHR (0.41) NAAAALDH1A1SMN1; SMN2
SCHEMBL11637458 0.83 CHRM2 (0.33) NAAAUSP2ALDH1A1ALOX15TDP1
SCHEMBL3641088 0.78
SCHEMBL8092499 0.77 TSHR (0.42)
SCHEMBL8429838 0.73 LMNA (0.47) USP2ALDH1A1ALOX15TDP1
SCHEMBL18570723 0.70 LMNA (0.51) USP2ALDH1A1ALOX15TDP1
SCHEMBL2572873 0.70 NAAA (0.43) NAAASMN1; SMN2PRKCA
SCHEMBL11047917 0.68
SCHEMBL1702796 0.68

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
US-5863996-A ADDITION POLYMERIZATION AND CROSSLINKING THEN GELATION TO FORM PARTICLES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1999-01-26 US disclosed