Methane

Methane

SCHEMBL29181789

C.CC(C)COC(=O)CO

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 1/20 0.39
PRKCA P17252 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL1505728 0.97
SCHEMBL14566774 0.82
SCHEMBL822223 0.82
SCHEMBL1226601 0.81 PRKCA (0.39) TSHRALDH1A1TDP1L3MBTL1MAPT
SCHEMBL27835213 0.81 MAPT (0.37) TSHRALDH1A1TDP1L3MBTL1MAPT
SCHEMBL9841056 0.79 PRKCA (0.38) TSHRALDH1A1TDP1L3MBTL1MAPT
SCHEMBL9841064 0.79 PRKCA (0.38) TSHRALDH1A1TDP1L3MBTL1MAPT
Water SCHEMBL1226488 0.79 PRKCA (0.38) TSHRALDH1A1TDP1L3MBTL1MAPT
SCHEMBL22838023 0.79 MAPT (0.40) TSHRTDP1MAPTPRKCAKDM4E
Water SCHEMBL1228216 0.79 PRKCA (0.38) TSHRALDH1A1TDP1L3MBTL1MAPT

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-110618583-B Colored resin composition, color filter, and image display device 三菱化学株式会社 2024-02-23 CN disclosed