SCHEMBL8680292

SCHEMBL8680292

O=[N+]([O-])c1ccc2c(c1)C=CC1(Oc3ccc(Cl)cc3C=C1c1ccccc1)O2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.38
EPAS1 Q99814 3/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
MAPT P10636 4/20 0.37
HTT P42858 1/20 0.37
CA9 Q16790 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
GFER P55789 1/20 0.37
DRD5 P21918 1/20 0.36
DRD3 P35462 1/20 0.36
P2RY6 Q15077 1/20 0.36
HTR2C P28335 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
PDE7A Q13946 2/20 0.34
PDE7B Q9NP56 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34

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
SCHEMBL8684835 0.89 MEN1 (0.43) HIF1AEPAS1KMT2AMEN1MAPT
SCHEMBL8680987 0.87 NPSR1 (0.41) HIF1AEPAS1KMT2AMEN1MAPT
SCHEMBL8682348 0.86 KMT2A (0.34) KMT2AMEN1MAPTHTTDRD5
SCHEMBL8685159 0.79 HIF1A (0.36) HIF1AEPAS1KMT2AMEN1MAPT
SCHEMBL8680591 0.79 MAPT (0.35) HIF1AEPAS1KMT2AMEN1MAPT
SCHEMBL8682404 0.79 MEN1 (0.33) HIF1AEPAS1KMT2AMEN1GFER
SCHEMBL8680220 0.78 MAPT (0.43) KMT2AMEN1MAPTHTTCA9
SCHEMBL8685169 0.76 CYP19A1 (0.34) HIF1AEPAS1KMT2AMEN1MAPT
SCHEMBL8680802 0.75 MEN1 (0.33) HIF1AEPAS1KMT2AMEN1GFER
SCHEMBL8681977 0.75 KMT2A (0.33) HIF1AEPAS1KMT2AMEN1GFER

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-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US claimed
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US disclosed
US-5710420-A Method for embedding and recovering machine-readable information XEROX CORPORATION (US) 1998-01-20 US disclosed
US-5633109-A Ink compositions with liposomes containing photochromic compounds XEROX CORPORATION (US) 1997-05-27 US disclosed
US-5593486-A Photochromic hot melt ink compositions XEROX CORPORATION (US) 1997-01-14 US disclosed
US-5551973-A LIQUID CRYSTAL GEL PHASE, MICROEMULSION PHASE XEROX CORPORATION (US) 1996-09-03 US disclosed