SCHEMBL8680411

SCHEMBL8680411

CC1=Cc2cc(Br)ccc2OC12Sc1ccccc1N2C

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.33
GAA P10253 2/20 0.32
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
ALPG P10696 1/20 0.32
RECQL P46063 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
ALOX15 P16050 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8680866 0.90
SCHEMBL8682318 0.85 MAPT (0.38) NPSR1GAAMAPTLMNAALPG
SCHEMBL8681148 0.83
SCHEMBL8680545 0.83 PAX8 (0.32) GAAMAPTLMNARECQLTDP1
SCHEMBL8678921 0.82 SNCA (0.38) GAAMAPTLMNAMEN1KMT2A
SCHEMBL8680439 0.82 SNCA (0.40) MAPTLMNATDP1MEN1KMT2A
SCHEMBL26780648 0.80 NOX1 (0.37) NPSR1MAPTLMNATDP1TP53
SCHEMBL8680008 0.76 MAPK1 (0.38) MAPTMEN1TP53KMT2A
SCHEMBL8684684 0.75 NPSR1 (0.42) NPSR1GAAMAPTLMNAALPG
SCHEMBL8680938 0.72 MEN1 (0.38) MAPTTDP1MEN1KMT2A

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