SCHEMBL8685173

SCHEMBL8685173

COc1cc([N+](=O)[O-])c(Br)c2c1OC1(C(C)=C2)N(C)c2ccccc2C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 4/20 0.41
ALDH1A1 P00352 4/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
S1PR1 P21453 2/20 0.31
PTK2 Q05397 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL8680397 0.90 MAPK1 (0.42) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8684907 0.86 MAPT (0.43) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL30612737 0.81 MAPT (0.42) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8680131 0.81 MAPT (0.42) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8680552 0.81 SMN1; SMN2 (0.50) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8685259 0.78 SMN1; SMN2 (0.52) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8680356 0.78 SMN1; SMN2 (0.41) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8680256 0.77 MAPK1 (0.53) MAPK1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL8680619 0.75 MAPT (0.34) MAPK1SMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL8685160 0.75 SMN1; SMN2 (0.65) MAPK1SMN1; SMN2MAPTALDH1A1MEN1

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