SCHEMBL8679984

SCHEMBL8679984

CCCCN1c2ccccc2SC12Oc1ccc([N+](=O)[O-])cc1C=C2c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
DRD1 P21728 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A4 P31645 1/20 0.33
DRD3 P35462 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
SNCA P37840 1/20 0.32
F2RL3 Q96RI0 4/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
GFER P55789 1/20 0.32
LMNA P02545 4/20 0.32
CYP19A1 P11511 1/20 0.32
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL8862463 0.95 L3MBTL1 (0.34) CHRM2HTR1AADRA2ADRD1PTGS1
SCHEMBL8684895 0.91 SNCA (0.34) CHRM2HTR1AADRA2ADRD1PTGS1
SCHEMBL8680283 0.87 L3MBTL1 (0.37) CHRM2HTR1AADRA2ADRD1PTGS1
SCHEMBL8684837 0.79 SNCA (0.36) CHRM2HTR1AADRA2ADRD1PTGS1
SCHEMBL8680101 0.78 SNCA (0.37) CHRM2HTR1AADRA2ADRD1PTGS1
SCHEMBL8862584 0.78 SNCA (0.35) CHRM2HTR1AADRA2ADRD1PTGS1
SCHEMBL8678921 0.76 SNCA (0.38) CHRM2HTR1AADRA2ADRD1PTGS1
SCHEMBL8680592 0.75 MAPT (0.33) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL1498117 0.72 MAPT (0.33) NPC1RAB9AL3MBTL1SNCAF2RL3
SCHEMBL8680220 0.71 MAPT (0.43) NPC1RAB9AL3MBTL1MEN1KMT2A

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