SCHEMBL2173012

SCHEMBL2173012

C=Cc1c(C)cc(C)cc1C.N#CC(C#N)=C(C#N)C#N

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
EGFR P00533 5/20 0.32
ERBB2 P04626 3/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP13 P45452 1/20 0.31
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL11356059 0.82 RAPGEF4 (0.39) HPGDALDH1A1LMNACA1CA2
SCHEMBL106587 0.82 RAPGEF4 (0.39) HPGDALDH1A1LMNACA1CA2
Hydrogen Sulfide SCHEMBL29194420 0.80 RAPGEF4 (0.38) HPGDALDH1A1LMNACA1CA2
Methane SCHEMBL14658320 0.80 RAPGEF4 (0.38) HPGDALDH1A1LMNACA1CA2
SCHEMBL23832201 0.72 TTR (0.37) HPGDALDH1A1KMT2A
SCHEMBL1926974 0.71 HPGD (0.58) HPGDEGFRERBB2ALDH1A1LMNA
SCHEMBL18849429 0.70 RAPGEF4 (0.33) HPGDCA1CA2MMP1MMP2
SCHEMBL10416968 0.69 ALDH1A1 (0.46) ALDH1A1POLBKMT2ATDP1
SCHEMBL5381460 0.69 CYP3A4 (0.46) ALDH1A1LMNAKMT2ATDP1
SCHEMBL12976025 0.68 ALDH1A1 (0.46) HPGDALDH1A1LMNACA1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110180826-A1 PRINTING METHOD, METHOD FOR FORMING LIGHT EMITTING LAYER, METHOD FOR FORMING ORGANIC LIGHT EMITTING DEVICE, AND ORGANIC LIGHT EMITTING DEVICE DAI NIPPON PRINTING CO., LTD. (JP) 2011-07-28 US disclosed
US-20070007883-A1 Gravure plate, method for forming light-emitting layer or hole-injection layer using the same, and organic light-emitting device DAI NIPPON PRINTING CO., LTD. (JP) 2007-01-11 US disclosed
US-6650047-B2 Electroluminescent device and process for producing the same DAI NIPPON PRINTING CO., LTD. (JP) 2003-11-18 US disclosed
US-20030127969-A1 Electroluminescent device and process for producing the same DAI NIPPON PRINTING CO., LTD. (JP) 2003-07-10 US disclosed
US-6573650-B2 Electroluminescent device and process for producing the same DAI NIPPON PRINTING CO., LTD. (JP) 2003-06-03 US disclosed
US-20010022497-A1 Electroluminescent device and process for producing the same DAI NIPPON PRINTING CO., 2001-09-20 US disclosed