SCHEMBL8680760

SCHEMBL8680760

O=[N+]([O-])c1ccc2c(c1)C=CC1(O2)c2ccccc2Oc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
MAPT P10636 5/20 0.50
HTT P42858 1/20 0.50
CA9 Q16790 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
POLB P06746 2/20 0.42
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GFER P55789 1/20 0.42
HIF1A Q16665 4/20 0.41
EPAS1 Q99814 4/20 0.41
ALPL P05186 1/20 0.39
TLR3 O15455 1/20 0.38
CASP6 P55212 1/20 0.38
GAA P10253 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
LMNA P02545 1/20 0.36
ALPG P10696 1/20 0.36

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
SCHEMBL8685242 0.91 MEN1 (0.45) MEN1KMT2AMAPTHTTCA9
SCHEMBL8680187 0.83 SMN1; SMN2 (0.42) MEN1KMT2AMAPTHTTCA9
SCHEMBL8685248 0.82 MEN1 (0.39) MEN1KMT2AMAPTHTTCA9
SCHEMBL30697691 0.78 HTR2C (0.44) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL382367 0.78 HTR2C (0.44) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL11596337 0.77 MEN1 (0.42) MEN1KMT2AMAPTHTTCA9
SCHEMBL3193294 0.76 TLR3 (0.59) MEN1KMT2AMAPTHTTCA9
SCHEMBL8680106 0.75 MAPT (0.39) MEN1KMT2AMAPTHTTCA9
SCHEMBL26631755 0.75 MEN1 (0.50) MEN1KMT2AMAPTHTTCA9
SCHEMBL8679976 0.74 MEN1 (0.45) MEN1KMT2AMAPTHTTCA9

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