SCHEMBL13680425

SCHEMBL13680425

c1ccc(C2=NN(c3ccccc3)C(c3ccc(C4CC(c5ccccc5)=NN4c4ccccc4)cc3)C2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.75
ERBB2 P04626 6/20 0.75
MEN1 O00255 9/20 0.69
KMT2A Q03164 9/20 0.69
GAA P10253 4/20 0.69
PRKCZ Q05513 2/20 0.69
HSP90AA1 P07900 2/20 0.69
L3MBTL1 Q9Y468 4/20 0.68
ATM Q13315 5/20 0.65
KDM4E B2RXH2 4/20 0.65
ALDH1A1 P00352 4/20 0.65
GLA P06280 3/20 0.65
MAPT P10636 3/20 0.65
HPGD P15428 2/20 0.65
HTT P42858 1/20 0.65
GFER P55789 1/20 0.65
CA1 P00915 1/20 0.65
CA2 P00918 1/20 0.65
CFTR P13569 1/20 0.65
GOPC Q9HD26 1/20 0.65

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
SCHEMBL13680429 0.97 EGFR (0.71) EGFRERBB2MEN1KMT2AGAA
SCHEMBL23052404 0.96 MEN1 (0.73) EGFRERBB2MEN1KMT2AGAA
SCHEMBL395608 0.96 MEN1 (0.73) EGFRERBB2MEN1KMT2AGAA
SCHEMBL10361833 0.93 MEN1 (0.69) EGFRERBB2MEN1KMT2AGAA
SCHEMBL14338087 0.93 MEN1 (0.69) EGFRERBB2MEN1KMT2AGAA
SCHEMBL32681116 0.92 EGFR (0.66) EGFRERBB2MEN1KMT2AGAA
SCHEMBL8373384 0.92 PRKCZ (0.82) EGFRERBB2MEN1KMT2AGAA
SCHEMBL3896190 0.92 PRKCZ (0.82) EGFRERBB2MEN1KMT2APRKCZ
SCHEMBL27760024 0.92 EGFR (0.74) EGFRERBB2MEN1KMT2AGAA
SCHEMBL23962450 0.89 MEN1 (0.82) EGFRERBB2MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582364-B2 Utilizing phosphorescence which emits light efficiently with high luminance at low current density; flat panel displays NIPPON STEEL CHEMICAL CO., LTD. (JP) 2009-09-01 US disclosed
US-7582364-B2 Utilizing phosphorescence which emits light efficiently with high luminance at low current density; flat panel displays NIPPON STEEL CHEMICAL CO., LTD. (JP) 2009-09-01 US disclosed
US-7309833-B2 Photovoltaic devices comprising layer(s) of photoactive organics dissolved in high Tg polymers AIR PRODUCTS AND CHEMICALS, INC. (US) 2007-12-18 US disclosed
US-7309833-B2 Photovoltaic devices comprising layer(s) of photoactive organics dissolved in high Tg polymers AIR PRODUCTS AND CHEMICALS, INC. (US) 2007-12-18 US disclosed
US-20070012935-A1 Organic electroluminescent device NIPPON STEEL CHEMICAL CO., LTD. (JP) 2007-01-18 US disclosed
US-20070012935-A1 Organic electroluminescent device NIPPON STEEL CHEMICAL CO., LTD. (JP) 2007-01-18 US disclosed