Methane

Methane

SCHEMBL8209913

C.Nc1nc(N)nc(NCO)n1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
GPR68 Q15743 3/20 0.36
ADORA2A P29274 2/20 0.36
HTR2B P41595 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
HTR1A P08908 4/20 0.35
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
CYP1A2 P05177 1/20 0.33
CASP1 P29466 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
MCL1 Q07820 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DRD2 P14416 3/20 0.32
HTR2A P28223 3/20 0.32
HTR7 P34969 3/20 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
SCHEMBL11594242 0.97 CA1 (0.40) CA1CA2CA9GPR68ADORA2A
SCHEMBL66618 0.97 CA1 (0.40) CA1CA2CA9GPR68ADORA2A
Water SCHEMBL2935542 0.95 CA1 (0.39) CA1CA2CA9GPR68ADORA2A
Ethane SCHEMBL8201842 0.93 CA1 (0.38) CA1CA2CA9GPR68ADORA2A
Methyl Alcohol SCHEMBL736036 0.93 CA1 (0.38) CA1CA2CA9GPR68ADORA2A
SCHEMBL63021 0.92 MCL1 (0.38) CA1CA2CA9GPR68ADORA2A
Formaldehyde SCHEMBL14634454 0.91 CA1 (0.41) CA1CA2CA9GPR68ADORA2A
Alcohol SCHEMBL5090035 0.91 MEN1 (0.38) CA1CA2CA9GPR68ADORA2A
Methoxymethane SCHEMBL5804833 0.89 NPC1 (0.37) CA1CA2CA9GPR68ADORA2A
SCHEMBL13993369 0.89 CA1 (0.36) CA1CA2CA9GPR68ADORA2A

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
JP-54124036-A None JP disclosed
US-6048610-A MALEIC ANHYDRIDE FUNCTIONALIZED CHLORINATED POLYOLEFIN, A MALEIC ANHYDRIDE FUNCTIONALIZED BLOCK POLYSTYRENE COPOLYMER, AND A CROSSLINKING AGENT. INTERTAPE POLYMER GROUP, INC. (US) 2000-04-11 US disclosed
US-4199646-A Heat-activatable, pressure-sensitive adhesive tape or sheet NITTO ELECTRIC INDUSTRIAL CO., LTD. (JP) 1980-04-22 US disclosed
JP-S54124036-A FORMATION OF POWDER CLEAR FILM TOYOTA MOTOR CORP 1979-09-26 JP disclosed