SCHEMBL9317486

SCHEMBL9317486

CCOC(=O)CC(=O)CCCCCCCCCCCOC1CCCCO1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GAA P10253 2/20 0.38
EPHX2 P34913 7/20 0.37
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
FAAH O00519 1/20 0.34
NAAA Q02083 1/20 0.34

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
SCHEMBL19104103 0.96 MEN1 (0.44) MEN1KMT2AGAAEPHX2MGAM
SCHEMBL1263510 0.90 MEN1 (0.50) MEN1KMT2AEPHX2USP2ALDH1A1
SCHEMBL11537124 0.90 MEN1 (0.50) MEN1KMT2AEPHX2USP2ALDH1A1
SCHEMBL8003850 0.85 MEN1 (0.48) MEN1KMT2AEPHX2USP2ALDH1A1
SCHEMBL22325517 0.85 MEN1 (0.48) MEN1KMT2AEPHX2USP2ALDH1A1
SCHEMBL18350198 0.84 MEN1 (0.57) MEN1KMT2ANAAA
SCHEMBL22071027 0.83 KMT2A (0.49) MEN1KMT2A
SCHEMBL25132592 0.83 KMT2A (0.51) MEN1KMT2AALDH1A1TDP1NAAA
SCHEMBL20837278 0.83 MGAM (0.39) MEN1KMT2AGAAEPHX2ALDH1A1
SCHEMBL25340470 0.83 KMT2A (0.51) MEN1KMT2AALDH1A1TDP1NAAA

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-5278326-A Aromatic WARNER-LAMBERT COMPANY (US) 1994-01-11 US disclosed