Methane

Methane

SCHEMBL27583285

C.C(=Cc1ccccc1N=Nc1ccccc1)c1ccccc1

nearest known ligand 0.46

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 4/20 0.46
TRPA1 O75762 2/20 0.46
ALDH1A1 P00352 1/20 0.44
NQO2 P16083 1/20 0.43
CASP3 P42574 2/20 0.39
SENP7 Q9BQF6 2/20 0.39
SENP6 Q9GZR1 2/20 0.39
SENP8 Q96LD8 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
FTO Q9C0B1 1/20 0.39
SIGMAR1 Q99720 2/20 0.38
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAOB P27338 2/20 0.37
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL27805506 0.98 NFE2L2 (0.47) NFE2L2TRPA1ALDH1A1NQO2CASP3
SCHEMBL14690301 0.93 NQO2 (0.47) NFE2L2TRPA1ALDH1A1NQO2SIGMAR1
SCHEMBL14690304 0.93 NQO2 (0.47) NFE2L2TRPA1ALDH1A1NQO2SIGMAR1
SCHEMBL14690303 0.93 NQO2 (0.47) NFE2L2TRPA1ALDH1A1NQO2SIGMAR1
SCHEMBL14690157 0.90 NFE2L2 (0.54) NFE2L2TRPA1SIGMAR1MEN1KMT2A
SCHEMBL14690155 0.90 NFE2L2 (0.54) NFE2L2TRPA1SIGMAR1MEN1KMT2A
SCHEMBL14690153 0.90 NFE2L2 (0.54) NFE2L2TRPA1SIGMAR1MEN1KMT2A
SCHEMBL7652189 0.84 CASP3 (0.47) NFE2L2TRPA1ALDH1A1NQO2CASP3
(Z)-1,2-Diphenylethene SCHEMBL7712991 0.82 ALDH1A1 (0.67) NFE2L2TRPA1ALDH1A1MEN1MAPT
SCHEMBL28816868 0.79 ALDH1A1 (0.46) TRPA1ALDH1A1CASP3SENP7SENP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1475367-A Ink Recording element using wrinkle particals ��˹���´﹫˾ 2004-02-18 CN disclosed