SCHEMBL1301876

SCHEMBL1301876

CC(C)=CCC/C(C=O)=C/CO

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
ALOX15 P16050 3/20 0.56
MEN1 O00255 2/20 0.56
CYP3A4 P08684 2/20 0.56
ALDH1A1 P00352 3/20 0.54
MAPT P10636 2/20 0.54
UGT1A1 P22309 1/20 0.54
SQLE Q14534 5/20 0.42
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL1301879 1.00 KMT2A (0.56) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL1301873 1.00 KMT2A (0.56) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL11301040 0.87 KMT2A (0.71) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL11310161 0.87 KMT2A (0.71) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL11301036 0.87 KMT2A (0.71) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL11310163 0.87 KMT2A (0.71) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL9588244 0.82 ALDH1A1 (0.50) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL9588238 0.82 ALDH1A1 (0.50) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL1301033 0.78 ALDH1A1 (0.63) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL395462 0.78 ALDH1A1 (0.63) KMT2AALOX15MEN1CYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015128428-A1 PHEROMONE DISPENSER MADE OF PLASTIC MATERIAL BASF SE (DE) 2015-09-03 WO disclosed
EP-2384111-A1 PHEROMONE DISPENSER BASF SE (DE) 2011-11-09 EP disclosed
US-20110266361-A1 PHEROMONE DISPENSER BASF SE (DE) 2011-11-03 US disclosed
WO-2010076316-A1 PHEROMONE DISPENSER BASF SE (DE) 2010-07-08 WO disclosed