Methane

Methane

SCHEMBL28630381

C.c1ccc2c(c1)OCCO2

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 1/20 0.93
ICAM1 P05362 1/20 0.93
ITGAL P20701 1/20 0.93
SMN1; SMN2 Q16637 3/20 0.78
LMNA P02545 3/20 0.78
CRHBP P24387 2/20 0.78
CRHR2 Q13324 2/20 0.78
HTT P42858 2/20 0.78
ABCG2 Q9UNQ0 1/20 0.61
GAA P10253 2/20 0.52
KDM4E B2RXH2 1/20 0.44
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
NOTUM Q6P988 1/20 0.42
MAPT P10636 2/20 0.41
BLM P54132 1/20 0.41
PDK1 Q15118 1/20 0.41
ADRB1 P08588 1/20 0.41
RAB9A P51151 1/20 0.40
KEAP1 Q14145 1/20 0.40

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
SCHEMBL29997436 0.97 ITGB2 (1.00) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL11399163 0.97 ITGB2 (1.00) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL8518 0.97 ITGB2 (1.00) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL11406989 0.97 ITGB2 (1.00) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL6791411 0.97 ITGB2 (1.00) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL27796077 0.97 ITGB2 (1.00) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL11519392 0.97 ITGB2 (1.00) ITGB2ICAM1ITGALSMN1; SMN2LMNA
Benzene SCHEMBL28072178 0.93 ITGB2 (0.93) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL28311086 0.93 ITGB2 (0.93) ITGB2ICAM1ITGALSMN1; SMN2LMNA
SCHEMBL11557715 0.93 ITGB2 (0.93) ITGB2ICAM1ITGALSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113416317-B A method for separating C-type lignin and G/S-type lignin from seed coat of Euphorbiaceae plant 北京林业大学 2021-11-09 CN disclosed
CN-113416317-A A method for separating C-type lignin and G/S-type lignin from seed coat of Euphorbiaceae plant 北京林业大学 2021-09-21 CN disclosed