SCHEMBL8685248

SCHEMBL8685248

O=[N+]([O-])c1ccc2c3c(ccc2c1)OC1(C=C3)c2ccccc2Oc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.39
KMT2A Q03164 8/20 0.39
MAPT P10636 5/20 0.39
HTT P42858 2/20 0.39
ALDH1A1 P00352 3/20 0.37
POLB P06746 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
ALPL P05186 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
CA9 Q16790 2/20 0.33
CASP6 P55212 1/20 0.33
CA12 O43570 1/20 0.33

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
SCHEMBL8680148 0.87 NPC1 (0.33) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL8680760 0.82 MEN1 (0.50) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL8682148 0.81 XDH (0.37) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL8682352 0.80 SNCA (0.32) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL3884117 0.80 CA9 (0.37) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL8681103 0.79 KDM4E (0.50) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL619662 0.76 MAOB (0.38) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL8862663 0.76 SMN1; SMN2 (0.36) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL8681962 0.76 MAPT (0.52) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL8680380 0.76 MAOB (0.38) MEN1KMT2AMAPTHTTALDH1A1

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