SCHEMBL27437786

SCHEMBL27437786

CC(C)=CCCC(C)=CCCC(C)=CCCOCCC=C(C)CCC=C(C)CCC=C(C)C

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.70
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 2/20 0.61
UGT1A1 P22309 1/20 0.61
SQLE Q14534 7/20 0.59
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
SCHEMBL28342394 1.00 KMT2A (0.70) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL9417664 0.90 KMT2A (0.61) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL9417662 0.90 KMT2A (0.61) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL3358100 0.85 KMT2A (0.43) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL16682277 0.85 KMT2A (0.55) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL19841923 0.84 KMT2A (0.67) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL3269528 0.83 FNTA (0.54) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL3269523 0.83 FNTA (0.54) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL23802597 0.83 KMT2A (1.00) KMT2AALOX15MAPTMEN1CYP3A4
Squalene SCHEMBL890053 0.83 KMT2A (1.00) KMT2AALOX15MAPTMEN1CYP3A4

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
CN-1125382-A Miticidal composition and method for controlling spider mite populations FERMONE CORP INC (US) 1996-06-26 CN disclosed