SCHEMBL3511796

SCHEMBL3511796

N#CC(C#N)CCCCCN

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA3 P07451 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA5A P35218 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CA5B Q9Y2D0 2/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.42
BLM P54132 1/20 0.42
NFKB1 P19838 1/20 0.37
GSR P00390 1/20 0.34
CPB2 Q96IY4 2/20 0.34
RNPEP Q9H4A4 1/20 0.33
MEN1 O00255 1/20 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
SCHEMBL5586257 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL5586240 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL5586243 0.89
SCHEMBL22996729 0.86
SCHEMBL6931904 0.83
SCHEMBL819370 0.83 TSHR (0.30) TSHR
SCHEMBL21874813 0.76 TSHR (0.30) TSHR
SCHEMBL23700073 0.76 TSHR (0.40) TSHRALDH1A1
SCHEMBL23700068 0.76 TSHR (0.40) TSHRALDH1A1
SCHEMBL23700089 0.76 TSHR (0.40) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7662314-B2 Conductive organic/inorganic composite composition and organic electroluminescent device comprising the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2010-02-16 US claimed
US-20060175964-A1 Conductive organic/inorganic composite composition and organic electroluminescent device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2006-08-10 US claimed
US-7662314-B2 Conductive organic/inorganic composite composition and organic electroluminescent device comprising the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2010-02-16 US disclosed
US-20060175964-A1 Conductive organic/inorganic composite composition and organic electroluminescent device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2006-08-10 US disclosed