SCHEMBL12856493

SCHEMBL12856493

O=C(c1ccc(Br)cc1)c1ccc(C(c2ccc(C(=O)c3ccc(Br)cc3)cc2)(c2ccc(C(=O)c3ccc(Br)cc3)cc2)c2ccc(C(=O)c3ccc(Br)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPT P10636 2/20 0.53
MAPK1 P28482 1/20 0.53
RAB9A P51151 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
SRD5A2 P31213 4/20 0.50
OGG1 O15527 1/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
AKR1C3 P42330 1/20 0.47
GSK3B P49841 2/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
GFER P55789 1/20 0.44

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
SCHEMBL2685393 0.87 SRD5A2 (0.68) LMNAMEN1KMT2AMAPTMAPK1
SCHEMBL132367 0.85 LMNA (0.73) LMNAMEN1KMT2AMAPTMAPK1
SCHEMBL3842531 0.85 LMNA (0.73) LMNAMEN1KMT2AMAPTMAPK1
SCHEMBL9126141 0.85 LMNA (0.73) LMNAMEN1KMT2AMAPTMAPK1
SCHEMBL29984922 0.83 LMNA (0.70) LMNAMEN1KMT2AMAPTMAPK1
SCHEMBL2685467 0.83 SRD5A2 (0.68) LMNAMEN1KMT2AMAPTMAPK1
Ethylene SCHEMBL10490014 0.80 LMNA (0.67) LMNAMEN1KMT2AMAPTMAPK1
SCHEMBL440244 0.80 CYP2A6 (0.57) MAPK1CES2CES1OGG1CA1
SCHEMBL28912876 0.80 CYP2A6 (0.57) MAPK1CES2CES1OGG1CA1
SCHEMBL8007545 0.79 MAPT (0.52) LMNAMEN1KMT2AMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2281861-A2 Mixture of organic emission-enabled semiconductors and matrix materials, use of same and electronic components containing same Merck Patent GmbH (DE) 2011-02-09 EP disclosed
US-7345301-B2 Mixtures of matrix materials and organic semiconductors capable of emission, use of the same and electronic components containing said mixtures MERCK PATENT GMBH (DE) 2008-03-18 US disclosed
US-7345301-B2 Mixtures of matrix materials and organic semiconductors capable of emission, use of the same and electronic components containing said mixtures MERCK PATENT GMBH (DE) 2008-03-18 US disclosed