SCHEMBL3894760

SCHEMBL3894760

CN(C)c1ccc2c(c1)Oc1ccc3ccccc3c1N2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 2/20 0.34
GAA P10253 2/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 2/20 0.34
TAAR1 Q96RJ0 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALOX5 P09917 6/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TERT O14746 1/20 0.33
APP P05067 1/20 0.33
RRM1 P23921 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL20497202 0.86 CYP1A2 (0.37) CYP1A2L3MBTL1NPC1GAAMAPT
SCHEMBL30530994 0.78 ALOX5 (0.55) CYP1A2GAATAAR1CYP2C19KDM4E
SCHEMBL121074 0.78 ALOX5 (0.55) CYP1A2GAATAAR1CYP2C19KDM4E
SCHEMBL31191628 0.78 ALOX5 (0.55) CYP1A2GAATAAR1CYP2C19KDM4E
SCHEMBL38660666 0.77 ALOX5 (0.41) MAPTKDM4EALDH1A1ALOX5TERT
SCHEMBL11677053 0.77 ALOX5 (0.41) MAPTKDM4EALDH1A1ALOX5TERT
Hydrochloric Acid SCHEMBL31235549 0.76 ALOX5 (0.53) CYP1A2GAATAAR1CYP2C19KDM4E
SCHEMBL28571843 0.76 ALOX5 (0.53) CYP1A2L3MBTL1GAATAAR1CYP2C19
SCHEMBL27344876 0.76 CA1 (0.47) CYP1A2GAAMAPTKDM4EALDH1A1
Hydrochloric Acid SCHEMBL18393328 0.76 ALOX5 (0.40) MAPTKDM4EALDH1A1ALOX5TERT

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8444716-B1 Soluble solid hair coloring article THE PROCTER & GAMBLE COMPANY (US) 2013-05-21 US disclosed
EP-1765592-B1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2009-01-28 EP disclosed
US-20080311524-A1 Method For Making Negative-Working Heat-Sensitive Lithographic Printing Plate Precursor AGFA GRAPHICS N.V. (BE) 2008-12-18 US disclosed
EP-1765592-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR Agfa Graphics N.V. (BE) 2007-03-28 EP disclosed
WO-2006005688-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR. AGFA-GEVAERT (BE) 2006-01-19 WO disclosed
EP-1614541-A2 Method of making a lithographic printing plate. Agfa-Gevaert (BE) 2006-01-11 EP disclosed
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 US disclosed