SCHEMBL6140001

SCHEMBL6140001

C1=CC2(Cc3ccccc3N2)Oc2c1ccc1cccnc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.33
CCR5 P51681 2/20 0.33
CCR8 P51685 2/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
TP53 P04637 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MMP2 P08253 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
MMP9 P14780 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
MMP8 P22894 1/20 0.33
THPO P40225 1/20 0.33
MTOR P42345 1/20 0.33
HTT P42858 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
SCHEMBL13326506 1.00 CCR1 (0.33) CCR1CCR5CCR8LMNAKDM4E
SCHEMBL8684691 0.83 KDM4E (0.32) LMNAKDM4ETP53MAPTTSHR
SCHEMBL29756140 0.74 SLC40A1 (0.36) CCR1CCR5CCR8LMNAKDM4E
SCHEMBL8680352 0.73 GAA (0.32) CYP3A4CYP2D6TSHR
SCHEMBL8862981 0.73
SCHEMBL30334650 0.72 LMNA (0.35) CCR1CCR5CCR8LMNAKDM4E
SCHEMBL8680347 0.72
SCHEMBL3039164 0.71 HTR2C (0.44) TP53MAPTTSHRHTT
SCHEMBL13326508 0.71 HTR2C (0.44) TP53MAPTTSHRHTT
SCHEMBL29715758 0.71 HTR2C (0.44) TP53MAPTTSHRHTT

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 19 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
WO-2023200716-A1 HYDROGRAPHIC SHEET FORMED OF A WATER-SOLUBLE FILM PROVIDED WITH NON-AQUEOUS INK OR DYE DECORATION ART CRAYOLA LLC (US) 2023-10-19 WO disclosed
WO-2023200714-A1 WATER-SOLUBLE FILM BASED DELIVERY SYSTEMS FOR COLORANTS, GLITTER, AND OTHER CHEMISTRIES CRAYOLA LLC (US) 2023-10-19 WO 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-20230323595-A1 WATER-SOLUBLE FILM BASED DELIVERY SYSTEMS FOR COLORANTS, GLITTER, AND OTHER CHEMISTRIES 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-7708396-B2 Photochromic phase change inks XEROX CORPORATION (US) 2010-05-04 US disclosed
US-20070211124-A1 PHOTOCHROMIC PHASE CHANGE INKS XEROX CORPORATION (US) 2007-09-13 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
EP-0562201-B1 UV-A, UV-B discrimination sensor NIPPON TELEGRAPH & TELEPHONE (JP) 1997-04-23 EP 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
EP-0562201-A1 UV-A, UV-B discrimination sensor NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1993-09-29 EP disclosed