Methane

Methane

SCHEMBL701905

C.Cc1ccc(N)c(N)c1C

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
CD44 P16070 1/20 0.46
CYP3A4 P08684 9/20 0.40
TDP1 Q9NUW8 7/20 0.40
ALDH1A1 P00352 7/20 0.40
TSHR P16473 5/20 0.40
CASP1 P29466 1/20 0.40
PIK3CA P42336 1/20 0.39
NOS3 P29474 2/20 0.37
NOS2 P35228 2/20 0.37
TP53 P04637 2/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34
MAPT P10636 2/20 0.33
NOS1 P29475 1/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 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
SCHEMBL34364 0.97 POLB (0.48) POLBCD44CYP3A4TDP1ALDH1A1
SCHEMBL29366969 0.97 POLB (0.48) POLBCD44CYP3A4TDP1ALDH1A1
Hydrochloric Acid SCHEMBL5183951 0.94 POLB (0.46) POLBCD44CYP3A4TDP1ALDH1A1
Hydrochloric Acid SCHEMBL10761313 0.94 POLB (0.46) POLBCD44CYP3A4TDP1ALDH1A1
SCHEMBL29087953 0.90 POLB (0.42) POLBCD44CYP3A4TDP1ALDH1A1
SCHEMBL29087964 0.90 CD44 (0.42) POLBCD44CYP3A4TDP1ALDH1A1
Sulfuric Acid SCHEMBL30338570 0.84 ALDH1A1 (0.39) POLBCD44CYP3A4TDP1ALDH1A1
SCHEMBL974136 0.84 POLB (0.38) POLBCD44CYP3A4TDP1ALDH1A1
Carbamic Acid SCHEMBL8735463 0.84 TDP1 (0.41) POLBCD44CYP3A4TDP1ALDH1A1
SCHEMBL28680385 0.84 POLB (0.38) POLBCD44CYP3A4TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1769028-B1 GAS-BARRIER NANOCOMPOSITE COMPOSITION AND ARTICLE USING THE SAME LG CHEMICAL LTD (KR) 2014-09-03 EP disclosed
US-8124681-B2 Golf ball with high moisture barrier properties ACUSHNET COMPANY (US) 2012-02-28 US disclosed
EP-1817373-B1 ARTICLE HAVING BARRIER PROPERTY LG CHEMICAL LTD (KR) 2011-06-29 EP disclosed
US-7868080-B2 Gas-barrier nanocomposite composition and article using the same LG CHEM, LTD. (KR) 2011-01-11 US disclosed
US-20100151969-A1 GOLF BALL WITH HIGH MOISTURE BARRIER PROPERTIES JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2010-06-17 US disclosed
US-7695381-B1 Golf ball with high moisture barrier properties ACUSHNET COMPANY (US) 2010-04-13 US disclosed
EP-1819767-A4 ARTICLE HAVING HIGH BARRIER PROPERTY LG CHEMICAL LTD (KR) 2009-07-15 EP disclosed
EP-1769028-A4 GAS-BARRIER NANOCOMPOSITE COMPOSITION AND ARTICLE USING THE SAME LG CHEMICAL LTD (KR) 2009-03-11 EP disclosed
EP-1817373-A4 ARTICLE HAVING BARRIER PROPERTY LG CHEMICAL LTD (KR) 2008-12-03 EP disclosed
US-7368496-B2 Nanocomposite composition having super barrier property and article using the same LG CHEM, LTD. (KR) 2008-05-06 US disclosed
US-20060121227-A1 Pipe having barrier property LG CHEM. LTD. (KR) 2006-06-08 US disclosed
US-20060122312-A1 Nanocomposite composition having high barrier property LG CHEM, LTD. (KR) 2006-06-08 US disclosed
US-20060121224-A1 Article having high barrier property LG CHEM, LTD. (KR) 2006-06-08 US disclosed
WO-2006059835-A1 ARTICLE HAVING BARRIER PROPERTY LG CHEM. LTD. (KR) 2006-06-08 WO disclosed
US-20060121228-A1 Tube container having barrier property LG CHEM, LTD. (KR) 2006-06-08 US disclosed
US-20060122311-A1 Article having barrier property LG CHEM. LTD. (KR) 2006-06-08 US disclosed
WO-2006009360-A1 GAS-BARRIER NANOCOMPOSITE COMPOSITION AND ARTICLE USING THE SAME LG CHEM. LTD. (KR) 2006-01-26 WO disclosed
WO-2005115706-A1 METHOD OF PREPARING OF TUBE SHOULDER HAVING BARRIER PROPERTIES LG CHEM. LTD. (KR) 2005-12-08 WO disclosed
US-20050267244-A1 Method of preparing of tube shoulder having barrier properties LG CHEM. LTD. (KR) 2005-12-01 US disclosed
US-20050215694-A1 Nanocomposite composition having super barrier property and article using the same LG CHEM, LTD. (KR) 2005-09-29 US disclosed