Methane

Methane

SCHEMBL29181734

C.c1ccc(-c2cccc3ccccc23)cc1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.59
HDAC8 Q9BY41 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
CA12 O43570 3/20 0.53
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA9 Q16790 3/20 0.53
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.53
MAPT P10636 2/20 0.53
HPGD P15428 2/20 0.53
TSHR P16473 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
TP53 P04637 1/20 0.53
NFKB1 P19838 1/20 0.53
MAPK1 P28482 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
ATM Q13315 1/20 0.53

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
Methane SCHEMBL27937952 0.98 TNF (0.57) TNFHDAC8HDAC6CA12CA1
SCHEMBL27988223 0.97 TNF (0.61) TNFHDAC8HDAC6CA12CA1
SCHEMBL29399206 0.97 TNF (0.61) TNFHDAC8HDAC6CA12CA1
SCHEMBL69345 0.97 TNF (0.61) TNFHDAC8HDAC6CA12CA1
Ammonia Solution, Strong SCHEMBL28321869 0.95 TNF (0.59) TNFHDAC8HDAC6CA12CA1
SCHEMBL27542612 0.95 TNF (0.59) TNFHDAC8HDAC6CA12CA1
Hydrogen Sulfide SCHEMBL29156136 0.95 TNF (0.59) TNFHDAC8HDAC6CA12CA1
SCHEMBL27937443 0.95 TNF (0.59) TNFHDAC8HDAC6CA12CA1
SCHEMBL316112 0.95 TNF (0.57) TNFHDAC8HDAC6CA12CA1
Biphenyl SCHEMBL4006980 0.93 CA12 (0.61) TNFHDAC8HDAC6CA12CA1

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-117487150-A Polycarbonate, preparation method and application thereof 万华化学集团股份有限公司 2024-02-02 CN disclosed