SCHEMBL5134545

SCHEMBL5134545

Oc1ccc(-n2c(-c3ccc(Br)cc3)ccc2-c2ccc(Br)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
ALOX15 P16050 1/20 0.52
RXFP1 Q9HBX9 1/20 0.44
POLB P06746 2/20 0.43
MAPT P10636 4/20 0.43
KDM4E B2RXH2 2/20 0.43
GLB1 P16278 1/20 0.42
CTRB1 P17538 1/20 0.42
CTRC Q99895 1/20 0.42
ALDH1A1 P00352 1/20 0.40
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
AR P10275 1/20 0.37
SMPD1 P17405 1/20 0.36

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
SCHEMBL6288437 0.93 MEN1 (0.59) MEN1KMT2AALOX15RXFP1POLB
SCHEMBL6287121 0.88 MEN1 (0.55) MEN1KMT2AALOX15RXFP1POLB
SCHEMBL6287200 0.86 MEN1 (0.53) MEN1KMT2AALOX15RXFP1POLB
SCHEMBL6279450 0.84 MEN1 (0.65) MEN1KMT2AALOX15RXFP1POLB
SCHEMBL6287858 0.81 MEN1 (0.70) MEN1KMT2AALOX15POLBMAPT
SCHEMBL12103668 0.80 ALDH1A1 (0.52) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL5012531 0.80 ALDH1A1 (0.52) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL5010856 0.80 MAPT (0.61) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL3253053 0.80 MEN1 (0.61) MEN1KMT2AALOX15RXFP1POLB
SCHEMBL1901745 0.80 MEN1 (0.76) MEN1KMT2AALOX15POLBMAPT

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
EP-1389626-B1 Aromatic copolymers of pyrroles and an electroluminescent element using the same KOREA INST SCI & TECH (KR) 2008-12-31 EP disclosed
US-6780950-B2 Pyrrole compounds, polymers thereof and EL element using the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-08-24 US disclosed
US-20040034189-A1 Pyrrole compounds, polymers thereof and EL element using the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY 2004-02-19 US disclosed
EP-1389626-A1 Aromatic copolymers of pyrroles and an electroluminescent element using the same Korea Institute of Science and Technology (KR) 2004-02-18 EP disclosed