SCHEMBL6139999

SCHEMBL6139999

C1=CC2(C=Cc3c(ccc4ccccc34)O2)Oc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.51
HPGD P15428 2/20 0.51
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
LMNA P02545 1/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
HTT P42858 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL30612751 1.00 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL30612735 0.91 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL5913910 0.91 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL8682698 0.87 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL8681961 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL30612722 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL8680602 0.85 NPC1 (0.43) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL8680374 0.85 KDM4E (0.43) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL8862536 0.83 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDMEN1NPC1
SCHEMBL8680618 0.82 ADRA1D (0.40) ALDH1A1KDM4EHPGDMEN1NPC1

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 14 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-20230323595-A1 WATER-SOLUBLE FILM BASED DELIVERY SYSTEMS FOR COLORANTS, GLITTER, AND OTHER CHEMISTRIES CRAYOLA LLC (US) 2023-10-12 US disclosed
US-20230323051-A1 WATER-SOLUBLE FILM BASED DELIVERY SYSTEMS FOR COLORANTS, GLITTER, AND OTHER ARTISTIC EFFECTS CRAYOLA LLC (US) 2023-10-12 US disclosed
US-11746235-B2 Two part silicone moldable eraser CRAYOLA LLC (US) 2023-09-05 US disclosed
US-11007813-B2 Integrated highlighting and shading marker system CRAYOLA LLC (US) 2021-05-18 US disclosed
US-20200399472-A1 TWO PART SILICONE MOLDABLE ERASER CRAYOLA LLC (US) 2020-12-24 US disclosed
US-20190329585-A1 INTEGRATED HIGHLIGHTING AND SHADING MARKER SYSTEM CRAYOLA LLC (US) 2019-10-31 US disclosed
US-20050019954-A1 Photochromic dyes for microsphere based sensor EASTMAN KODAK COMPANY 2005-01-27 US disclosed
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
US-4384094-A CHEMICAL INTERMEDIATES TO STABLE COLORED PYRYLIUM SALTS ARMSTRONG WORLD INDUSTRIES, INC. (US) 1983-05-17 US disclosed