SCHEMBL21686491

SCHEMBL21686491

Oc1ccc(/N=N/c2ccc(N(Cc3ccccn3)Cc3ccccn3)cc2)c(O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.51
MAPT P10636 5/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
KCNH2 Q12809 12/20 0.45
POLB P06746 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.42
RIOK2 Q9BVS4 1/20 0.41
MAPK1 P28482 2/20 0.40
KDM4E B2RXH2 2/20 0.40
GFER P55789 2/20 0.40
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL21686490 0.84 KCNH2 (0.39) MAPTMEN1KMT2AKCNH2LMNA
SCHEMBL21686489 0.84 PDK1 (0.45) MAPTKCNH2RIOK2TDP1L3MBTL1
SCHEMBL21686443 0.83 MEN1 (0.42) EGFRMAPTMEN1KMT2AALDH1A1
SCHEMBL21686464 0.81 MAPT (0.49) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL24282176 0.80 MEN1 (0.42) EGFRMAPTMEN1KMT2AALDH1A1
SCHEMBL21686606 0.80 GLO1 (0.42) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL24282175 0.76 CHRNA7 (0.40) EGFRMAPTMEN1KMT2AALDH1A1
SCHEMBL10486530 0.75 EGFR (0.65) EGFRMAPTMEN1KMT2AALDH1A1
SCHEMBL10486531 0.75 EGFR (0.65) EGFRMAPTMEN1KMT2AALDH1A1
SCHEMBL21686488 0.74 MAPT (0.56) MAPTMEN1KMT2AALDH1A1NPC1

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-3362518-B1 SENSOR DYES FOR REAL-TIME SENSING OF METAL IONS IN AQUEOUS ENVIRONMENTS THE UWM RES FOUNDATION INC (US) 2022-04-27 EP disclosed
US-11275071-B2 Sensor dyes for real-time sensing of metal ions in aqueous environments UWM RESEARCH FOUNDATION, INC. (US) 2022-03-15 US disclosed
US-20200033314-A1 SENSOR DYES FOR REAL-TIME SENSING OF METAL IONS IN AQUEOUS ENVIRONMENTS ADVANCED CHEMICAL SYSTEMS, INC. 2020-01-30 US disclosed