SCHEMBL11345733

SCHEMBL11345733

Cc1ccc(C)c2c1C(=N)NC2=N

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.33
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CD44 P16070 1/20 0.32
CASP1 P29466 1/20 0.32
CYP1A2 P05177 1/20 0.32
CES1 P23141 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
TSHR P16473 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL18663500 0.85 CES1 (0.46) POLBCD44CES1
SCHEMBL7815737 0.78 CA1 (0.41) POLBALDH1A1CD44CYP1A2TSHR
SCHEMBL11622426 0.75 TDP2 (0.46) POLB
SCHEMBL15984397 0.73 THRB (0.41)
SCHEMBL4160455 0.71 ALDH1A1 (0.44) POLBALDH1A1PRSS1PRSS2PRSS3
SCHEMBL13297043 0.67 CES1 (0.39) CYP1A2CES1
SCHEMBL8623574 0.67 ALDH1A1 (0.37) POLBALDH1A1PRSS1PRSS2PRSS3
SCHEMBL11519039 0.67 PARP1 (0.44) POLBCES1
SCHEMBL18663492 0.65 CES1 (0.42) POLBCES1
SCHEMBL18663477 0.65

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-8220911-B2 Inkjet recording method FUJIFILM CORPORATION (JP) 2012-07-17 US disclosed
US-8053046-B2 Ink for inkjet printing, ink set for inkjet printing, inkjet recording material and producing method for inkjet recording material, and inkjet recording method FUJIFILM CORPORATION (JP) 2011-11-08 US disclosed
US-7909447-B2 Inkjet recording method and inkjet-recording material FUJIFILM CORPORATION (JP) 2011-03-22 US disclosed
US-20100247816-A1 INK FOR INKJET PRINTING, INK SET FOR INKJET PRINTING, INKJET RECORDING MATERIAL AND PRODUCING METHOD FOR INKJET RECORDING MATERIAL, AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed
US-20090231402-A1 INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2009-09-17 US disclosed
US-7527684-B2 Ink set and ink jet recording method FUJIFILM CORPORATION (JP) 2009-05-05 US disclosed
US-7500743-B2 Ink jet recording method and ink jet image FUJIFILM CORPORATION (JP) 2009-03-10 US disclosed
US-20080043078-A1 Ink Set and Ink Jet Recording Method FUJIFILM CORPORATION (JP) 2008-02-21 US disclosed
US-7291213-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2007-11-06 US disclosed
US-20070172608-A1 Inkjet-recording medium, production method thereof, inkjet-recording method, inkjet-recording set, and inkjet-recording object FUJIFILM CORPORATION (JP) 2007-07-26 US disclosed
US-20070171267-A1 Inkjet-recording method and injet-recording material FUJIFILM CORPORATION (JP) 2007-07-26 US disclosed
US-7223453-B2 Ink jet recording medium and ink jet recording method FUJIFILM CORPORATION (JP) 2007-05-29 US disclosed
US-7220302-B2 Ink and ink set for inkjet, and inkjet recording method FUJIFILM CORPORATION (JP) 2007-05-22 US disclosed
US-20070052783-A1 Ink for inkjet printing ink set for inkjet printing inkjet recording material and producing method for inkjet recording material and inkjet recording method FUJIFILM CORPORATION (JP) 2007-03-08 US disclosed