SCHEMBL8616387

SCHEMBL8616387

C=CCN(CC=C)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.60
MAPT P10636 6/20 0.60
MEN1 O00255 6/20 0.60
KMT2A Q03164 6/20 0.60
POLB P06746 3/20 0.60
HTT P42858 3/20 0.60
NPSR1 Q6W5P4 2/20 0.60
LMNA P02545 2/20 0.60
TDP1 Q9NUW8 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MAPK1 P28482 2/20 0.41
HSP90AA1 P07900 1/20 0.41
RECQL P46063 1/20 0.41
MMP14 P50281 1/20 0.41
GAA P10253 2/20 0.40
KCNH2 Q12809 1/20 0.39
GLA P06280 1/20 0.39
RXFP1 Q9HBX9 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
SCHEMBL8612280 0.89 MAPT (0.57) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL16790560 0.88 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL8611566 0.86 MAPT (0.44) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL3263007 0.85 MMP14 (0.47) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL3263010 0.85 MMP14 (0.47) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL19706419 0.84 MAPT (0.64) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL8613470 0.82 MEN1 (0.41) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL8611406 0.78 ALDH1A1 (0.56) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL13758730 0.77 MAPT (0.86) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL129460 0.76 ALDH1A1 (0.48) ALDH1A1MAPTMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0554904-B1 Organosilicon polymers, and dyes, exhibiting nonlinear optical response ALLIANT TECHSYSTEMS INC (US) 1998-06-10 EP disclosed
US-5714304-A AN ORGANOSILICON CROSSLINKED POLYMER IS THE REACTION PRODUCT OF ATLEAST ONE CYCLIC POLYSILOXANE HAVING ATLEAST TWO HYDROSILATION REACTIVE GROUPS, AN ORGANIC DYE WITH ELECTRON ACCEPTOR AND DONOR GROUPS WITH DOUBLE BOND, AND A POLYENE HERCULES INCORPORATED (US) 1998-02-03 US disclosed
US-5663308-A DYES CONTAINING ELECTRON DONOR/ACEPTOR GROUPS LINKED BY DELOCALIZED PI ELECTRON SYSTEM AND TWO OR MORE PENDANT GROUPS HERCULES INCORPORATED (US) 1997-09-02 US disclosed
US-5605726-A FILMS, SEMICONDUCTORS HERECULES INCORPORATED (US) 1997-02-25 US disclosed
US-5298588-A Organosilicon polymers, and dyes, exhibiting nonlinear optical response HERCULES INCORPORATED (US) 1994-03-29 US disclosed
US-5254655-A Made by hydrosilation of cyclic polysiloxanes and carbon-carbon bond-containing dye HERCULES INCORPORATED (US) 1993-10-19 US disclosed
EP-0554904-A2 Organosilicon polymers, and dyes, exhibiting nonlinear optical response HERCULES INCORPORATED (US) 1993-08-11 EP disclosed