SCHEMBL2359402

SCHEMBL2359402

[CH2]CC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CCC=C(C)C

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.77
SQLE Q14534 8/20 0.65
ALOX15 P16050 3/20 0.61
MAPT P10636 2/20 0.61
MEN1 O00255 2/20 0.61
CYP3A4 P08684 2/20 0.61
ALDH1A1 P00352 1/20 0.61
UGT1A1 P22309 1/20 0.61
KDM4E B2RXH2 1/20 0.55

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
SCHEMBL20582749 1.00 KMT2A (0.77) KMT2ASQLEALOX15MAPTMEN1
SCHEMBL29085388 0.95 KMT2A (0.68) KMT2ASQLEALOX15MAPTMEN1
SCHEMBL23581543 0.88 KMT2A (0.73) KMT2ASQLEALOX15MAPTMEN1
SCHEMBL11290924 0.88 KMT2A (0.73) KMT2ASQLEALOX15MAPTMEN1
SCHEMBL8850002 0.88 KMT2A (0.73) KMT2ASQLEALOX15MAPTMEN1
SCHEMBL21639794 0.88 KMT2A (1.00) KMT2ASQLEALOX15MAPTMEN1
Squalene SCHEMBL890053 0.88 KMT2A (1.00) KMT2ASQLEALOX15MAPTMEN1
Squalene SCHEMBL21823197 0.88 KMT2A (1.00) KMT2ASQLEALOX15MAPTMEN1
SCHEMBL8013144 0.88 KMT2A (1.00) KMT2ASQLEALOX15MAPTMEN1
SCHEMBL23802597 0.88 KMT2A (1.00) KMT2ASQLEALOX15MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2355800-A1 NANOPARTICLES OF BETA-LACTAM DERIVATIVES Centre National de la Recherche Scientifique (FR) 2011-08-17 EP disclosed
WO-2010049899-A1 NANOPARTICLES OF BETA-LACTAM DERIVATIVES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-05-06 WO disclosed