SCHEMBL16945136

SCHEMBL16945136

Brc1ccc2c(c1)c1cc(Br)ccc1c1nc3ccccc3nc21

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 8/20 0.55
MYC P01106 1/20 0.48
MAX P61244 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2A6 P11509 1/20 0.41
MAPT P10636 2/20 0.40
PDPK1 O15530 1/20 0.40
PIK3R1 P27986 1/20 0.40
PIK3CA P42336 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ADRB2 P07550 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
SCHEMBL13647624 0.92 NQO2 (0.55) NQO2MYCMAXMEN1KMT2A
SCHEMBL28465999 0.88 PIK3R1 (0.47) NQO2MEN1KMT2ARXFP1PIK3R1
SCHEMBL30361349 0.88 PIK3R1 (0.47) NQO2MEN1KMT2ARXFP1PIK3R1
SCHEMBL19462996 0.84 MEN1 (0.40) MEN1KMT2ARXFP1MAPK1CYP2A6
SCHEMBL13647644 0.82 NQO2 (0.46) NQO2MYCMAXMEN1KMT2A
SCHEMBL29494618 0.80 PTGES (0.43) NQO2MEN1KMT2ARXFP1PIK3R1
SCHEMBL31544778 0.80 CHUK (0.42) NQO2MEN1KMT2ARXFP1
SCHEMBL29212042 0.76 NQO2 (0.47) NQO2MYCMAXMAPK1MAPT
SCHEMBL29983686 0.76 HTT (0.37) NQO2MEN1KMT2ARXFP1
SCHEMBL13330653 0.75 NQO2 (0.57) NQO2MYCMAXMEN1KMT2A

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
US-20150214484-A1 Organometallic Complex and Light Emitting Element, Light Emitting Device, and Electronic Device Using the Organometallic Complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-07-30 US disclosed
US-20150214484-A1 Organometallic Complex and Light Emitting Element, Light Emitting Device, and Electronic Device Using the Organometallic Complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-07-30 US disclosed