SCHEMBL109819

SCHEMBL109819

Cc1cc(C(c2ccc(N)cc2)c2ccc(N)cc2)ccc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.46
TDP1 Q9NUW8 6/20 0.46
ALDH1A1 P00352 5/20 0.46
TSHR P16473 4/20 0.46
CASP1 P29466 2/20 0.41
S100B P04271 1/20 0.37
ACHE P22303 1/20 0.37
SKP2 Q13309 1/20 0.36
MAPK1 P28482 2/20 0.36
HIF1A Q16665 2/20 0.35
GAA P10253 1/20 0.35
ALOX12 P18054 1/20 0.35
HTT P42858 1/20 0.35
THRB P10828 2/20 0.35
ALOX15 P16050 2/20 0.35
RECQL P46063 1/20 0.35
PDE10A Q9Y233 1/20 0.34
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 2/20 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
SCHEMBL30602820 1.00 CYP3A4 (0.46) CYP3A4TDP1ALDH1A1TSHRCASP1
SCHEMBL22044374 0.94 ALDH1A1 (0.52) CYP3A4TDP1ALDH1A1TSHRCASP1
SCHEMBL22044383 0.94 ALDH1A1 (0.48) CYP3A4TDP1ALDH1A1TSHRCASP1
SCHEMBL30749457 0.91 CYP3A4 (0.54) CYP3A4TDP1ALDH1A1TSHRCASP1
SCHEMBL5166514 0.91 CYP3A4 (0.54) CYP3A4TDP1ALDH1A1TSHRCASP1
SCHEMBL13070208 0.88 ALDH1A1 (0.46) CYP3A4TDP1ALDH1A1TSHRS100B
SCHEMBL31409207 0.88 ALDH1A1 (0.46) CYP3A4TDP1ALDH1A1TSHRS100B
SCHEMBL29278568 0.86 CYP3A4 (0.45) CYP3A4TDP1ALDH1A1TSHRS100B
SCHEMBL743578 0.86 CYP3A4 (0.45) CYP3A4TDP1ALDH1A1TSHRS100B
SCHEMBL22044753 0.85 ALDH1A1 (0.56) CYP3A4TDP1ALDH1A1TSHRCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424491-B1 FILM FORMER IN HAIR COLOURS HENKEL AG & CO KGAA (DE) 2017-05-24 EP disclosed
EP-1975226-B1 Liquid treatment composition PROCTER & GAMBLE (US) 2013-02-13 EP disclosed
EP-2424491-A2 FILM FORMER IN HAIR DYES Henkel AG & Co. KGaA (DE) 2012-03-07 EP disclosed
EP-1996687-B1 LAUNDRY COMPOSITION PROCTER & GAMBLE (US) 2011-10-26 EP disclosed
US-8003589-B2 Laundry composition THE PROCTER & GAMBLE COMPANY (US) 2011-08-23 US disclosed
US-8003589-B2 Laundry composition THE PROCTER & GAMBLE COMPANY (US) 2011-08-23 US disclosed
EP-1761623-B1 LAUNDRY DETERGENT COMPOSITIONS WITH EFFICIENT HUEING DYE PROCTER & GAMBLE (US) 2010-11-17 EP disclosed
WO-2010124897-A2 FILM FORMER IN HAIR DYES HENKEL AG & CO. KGAA (DE) 2010-11-04 WO disclosed
US-20090186797-A1 LAUNDRY COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2009-07-23 US disclosed
US-20090186797-A1 LAUNDRY COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2009-07-23 US disclosed
EP-0156912-B1 TEMPERATURE SUPERVISION AND DISPLAY UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-05-13 EP disclosed
EP-0239868-B1 PHOTOCHROMIC SYSTEM, LAYER PREPARED THEREOF AND ITS USE BASF Aktiengesellschaft (DE) 1989-12-27 EP disclosed
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
US-4729671-A FOR FROZEN FOODS AND DRUGS, METHANE DYES MITSUI TOATSU CHEMICALS, INC. (JP) 1988-03-08 US disclosed
EP-0239868-A1 Photochromic system, layer prepared thereof and its use BASF Aktiengesellschaft (DE) 1987-10-07 EP disclosed
EP-0156912-A1 TEMPERATURE SUPERVISION AND DISPLAY UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-10-09 EP disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 US disclosed