SCHEMBL9437268

SCHEMBL9437268

COCCOCCOCCNC(=O)CCC(=O)NCCCCCNC(=O)CC(OCc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ HPGD P15428 5/20 0.46
▸ EPOR P19235 5/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ HTT P42858 1/20 0.40

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
SCHEMBL9073845 0.80 CYP3A4 (0.51) HPGDALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL20151955 0.77 SMN1; SMN2 (0.53) LMNAKDM4EHPGDKMT2AMEN1
SCHEMBL29336441 0.77 LMNA (0.46) LMNAKDM4EHPGDEPORALDH1A1
SCHEMBL14788798 0.76 LMNA (0.60) LMNAKDM4EHPGDEPORALDH1A1
SCHEMBL15784537 0.76 LMNA (0.54) LMNAKDM4EHPGDEPORKMT2A
SCHEMBL29467642 0.73 LMNA (0.54) LMNAALDH1A1SMN1; SMN2
SCHEMBL30189707 0.73 HTT (0.68) LMNAEPORKMT2AMEN1SMN1; SMN2
SCHEMBL9437258 0.73 EPOR (0.47) LMNAKDM4EHPGDEPORSMN1; SMN2
SCHEMBL9541981 0.71 LMNA (0.46) LMNAKDM4EHPGDEPORKMT2A
SCHEMBL29336444 0.71 LMNA (0.54) LMNAKDM4EALDH1A1SMN1; SMN2

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-5367113-A Iron chelate compounds with polyether derivatives UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 1994-11-22 — — US disclosed
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