Methane

Methane

SCHEMBL230118

C.CC(C)(C)CCC(=O)c1ccccc1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.55
TDP1 Q9NUW8 3/20 0.55
MAPT P10636 3/20 0.55
LMNA P02545 2/20 0.55
NR4A2 P43354 1/20 0.55
KMT2A Q03164 3/20 0.53
MAPK1 P28482 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HDAC1 Q13547 3/20 0.50
HDAC8 Q9BY41 3/20 0.50
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX15 P16050 1/20 0.50
CES1 P23141 1/20 0.50
GAA P10253 1/20 0.50
CYP2C19 P33261 1/20 0.50
HDAC3 O15379 1/20 0.50

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
SCHEMBL12601655 0.98 L3MBTL1 (0.57) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL16284851 0.87 SMN1; SMN2 (0.66) L3MBTL1MAPTLMNAMAPK1ALDH1A1
SCHEMBL2739389 0.86 L3MBTL1 (0.64) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL25341336 0.84 L3MBTL1 (0.55) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL28033898 0.84 L3MBTL1 (0.55) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL8189868 0.83 KMT2A (0.55) L3MBTL1TDP1MAPTLMNANR4A2
Hydrochloric Acid SCHEMBL7006619 0.81 MMP1 (0.57) L3MBTL1TDP1MAPTLMNAKMT2A
SCHEMBL27600565 0.81 ITGB3 (0.43) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL28807012 0.81 L3MBTL1 (0.52) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL25340770 0.81 L3MBTL1 (0.52) L3MBTL1TDP1MAPTLMNANR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408889-B1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO KGAA (DE) 2012-12-26 EP claimed
US-20120003326-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO. KGAA (DE) 2012-01-05 US claimed
EP-2408889-B1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO KGAA (DE) 2012-12-26 EP disclosed
WO-2012107113-A1 FUNCTIONAL INK HENKEL AG & CO. KGAA (DE) 2012-08-16 WO disclosed
EP-2408889-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT Henkel AG & Co. KGaA (DE) 2012-01-25 EP disclosed
US-20120003326-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO. KGAA (DE) 2012-01-05 US disclosed
WO-2010105949-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO. KGAA (DE) 2010-09-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120003326-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT CAT, GPX4, WASHC4 L3MBTL1 3965/4885TDP1 2308/4885MAPT 4025/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.