SCHEMBL6891431

SCHEMBL6891431

CCCC(C)C1(c2ccc(C#N)cc2)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 16/20 0.40
SLC6A4 P31645 15/20 0.40
SLC6A2 P23975 4/20 0.37
CYP19A1 P11511 1/20 0.36
CYP2A6 P11509 1/20 0.36
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL10586709 0.96 SLC6A3 (0.43) SLC6A3SLC6A4SLC6A2CYP19A1HRH3
SCHEMBL7602161 0.87 SLC6A3 (0.41) SLC6A3SLC6A4SLC6A2CYP19A1CYP2A6
SCHEMBL10591071 0.80 SLC6A4 (0.43) SLC6A3SLC6A4SLC6A2CYP19A1
SCHEMBL10708461 0.79 SLC6A4 (0.47) SLC6A3SLC6A4SLC6A2
SCHEMBL9485781 0.79 SLC6A4 (0.42) SLC6A3SLC6A4SLC6A2CYP19A1CYP2A6
SCHEMBL11524015 0.78 SLC6A4 (0.63) SLC6A3SLC6A4SLC6A2
SCHEMBL5904402 0.76 SLC6A4 (0.58) SLC6A3SLC6A4SLC6A2
SCHEMBL10482246 0.75 HSD11B1 (0.35) SLC6A3HRH3
SCHEMBL9485946 0.73 SLC6A3 (0.38) SLC6A3SLC6A4SLC6A2CYP19A1CYP2A6
SCHEMBL8982370 0.73 SLC6A4 (0.41) SLC6A3SLC6A4SLC6A2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010044012-A1 Transparent substrate between a hydrophilic ink receiving layer and a colored hydrophobic luminescent layer; creating photographic quality prints XEROX CORPORATION 2001-11-22 US claimed
US-6319591-B1 Ink jet recording substrates XEROX CORPORATION 2001-11-20 US claimed
EP-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 EP claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP claimed
EP-0743573-A2 Method for obtaining image contrast migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US claimed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US claimed
EP-0903383-B1 Hot melt ink compositions XEROX CORP (US) 2004-07-07 EP disclosed
US-20010044012-A1 Transparent substrate between a hydrophilic ink receiving layer and a colored hydrophobic luminescent layer; creating photographic quality prints XEROX CORPORATION 2001-11-22 US disclosed
US-6319591-B1 Ink jet recording substrates XEROX CORPORATION 2001-11-20 US disclosed
EP-0877298-B1 Coated xerographic photographic paper XEROX CORP (US) 2001-08-29 EP disclosed
EP-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 EP disclosed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP disclosed
EP-0743573-A2 Method for obtaining image contrast migration imaging members XEROX CORPORATION (US) 1996-11-20 EP disclosed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP disclosed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US disclosed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US disclosed
EP-0427957-A2 Alkinyl-substituted liquid crystals F. HOFFMANN-LA ROCHE AG (CH) 1991-05-22 EP disclosed
EP-0410233-A2 (4-Arylbutyl) cyclohexane derivatives F. HOFFMANN-LA ROCHE AG (CH) 1991-01-30 EP disclosed