SCHEMBL8680353

SCHEMBL8680353

COc1cc([N+](=O)[O-])c(Br)c2c1OC1(C=C2)N(C)c2ccccc2C1(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 5/20 0.32
MEN1 O00255 3/20 0.32
MAPT P10636 5/20 0.32
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 2/20 0.32
ATM Q13315 1/20 0.31
GAA P10253 4/20 0.31
NPSR1 Q6W5P4 2/20 0.31
LMNA P02545 1/20 0.31
ALPG P10696 1/20 0.31
RECQL P46063 1/20 0.31
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GFER P55789 1/20 0.31
KDM4E B2RXH2 2/20 0.30
PLIN1 O60240 1/20 0.30
PABPC1 P11940 1/20 0.30

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
SCHEMBL8685178 0.90 SMN1; SMN2 (0.33) MAPK1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL30612737 0.88 MAPT (0.42) MAPK1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8680131 0.88 MAPT (0.42) MAPK1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8679974 0.86 ALDH1A1 (0.33) MAPK1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8680465 0.85 MEN1 (0.33) MAPK1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8682111 0.83 SMN1; SMN2 (0.34) MAPK1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8680619 0.82 MAPT (0.34) MAPK1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8680332 0.82 MEN1 (0.30) KMT2AMEN1
SCHEMBL8680167 0.82 MEN1 (0.40) KMT2AMEN1MAPTTDP1ATM
SCHEMBL8680621 0.81 MAPT (0.42) MAPK1SMN1; SMN2KMT2AMEN1MAPT

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