SCHEMBL11250647

SCHEMBL11250647

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CCC(C)CCC#N

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
ALOX15 P16050 3/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.46
CYP3A4 P08684 2/20 0.46
UGT1A1 P22309 1/20 0.46
SQLE Q14534 4/20 0.44
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL11250650 1.00 KMT2A (0.50) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL4869662 0.90 ALOX15 (0.59) ALOX15ALDH1A1
SCHEMBL9089885 0.86 ALDH1A1 (0.38) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL9089888 0.86 ALDH1A1 (0.38) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL10729108 0.85 KMT2A (0.52) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL10729116 0.85 KMT2A (0.52) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL10733007 0.85 KMT2A (0.52) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL7941574 0.85 KMT2A (0.52) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL7941569 0.85 KMT2A (0.52) KMT2AALOX15ALDH1A1MAPTMEN1
SCHEMBL10733011 0.85 KMT2A (0.52) KMT2AALOX15ALDH1A1MAPTMEN1

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-4325974-A β, γ-Dihydropolyprenyl alcohol and hypotensive pharmaceutical composition containing same EISAI CO., LTD. (JP) 1982-04-20 US disclosed