Methane

Methane

SCHEMBL2159555

C.CCSC(=O)N(CC)CC.[NaH]

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.60
MAPK1 P28482 1/20 0.60
ALDH1A1 P00352 5/20 0.40
LMNA P02545 2/20 0.37
PHGDH O43175 3/20 0.36
MGLL Q99685 3/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
HSD17B10 Q99714 3/20 0.33
ALDH2 P05091 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HPGD P15428 2/20 0.33
HTR1A P08908 2/20 0.33
PLIN1 O60240 1/20 0.33
GMNN O75496 1/20 0.33
TRPA1 O75762 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
SCHEMBL134304 0.95 TSHR (0.65) TSHRMAPK1ALDH1A1LMNAPHGDH
SCHEMBL4263485 0.92 TSHR (0.62) TSHRMAPK1ALDH1A1LMNAPHGDH
SCHEMBL24470878 0.79 TSHR (0.46) TSHRMAPK1ALDH1A1LMNAPHGDH
SCHEMBL21221413 0.79 PHGDH (0.50) TSHRMAPK1ALDH1A1LMNAPHGDH
SCHEMBL8104956 0.78 TSHR (0.63) TSHRMAPK1ALDH1A1LMNAMGLL
S-Ethyl Dipropylcarbamothioate SCHEMBL8541416 0.75 TSHR (1.00) TSHRMAPK1ALDH1A1KMT2AMEN1
S-Ethyl Dipropylcarbamothioate SCHEMBL66482 0.75 TSHR (1.00) TSHRMAPK1ALDH1A1KMT2AMEN1
SCHEMBL9420118 0.75 ALDH1A1 (0.49) TSHRMAPK1ALDH1A1LMNAPHGDH
Butylate SCHEMBL395574 0.75 TSHR (0.54) TSHRMAPK1ALDH1A1HSD17B10CA12
SCHEMBL11454569 0.74 TSHR (0.59) TSHRMAPK1ALDH1A1MGLLMMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231486-A1 COMPOUNDS FOR PRODUCING SUBSTITUTED SULFOXIDES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF MATRIX LABORATORIES LIMITED (IN) 2013-09-05 US disclosed
US-8513427-B2 Compounds for producing substituted sulfoxides, process for producing the same and use thereof MATRIX LABORATORIES LIMITED (IN) 2013-08-20 US disclosed
EP-2342193-B1 NOVEL COMPOUNDS FOR PRODUCING SUBSTITUTED SULFOXIDES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF MATRIX LAB LTD (IN) 2013-06-05 EP disclosed
US-20110184182-A1 COMPOUNDS FOR PRODUCING SUBSTITUTED SULFOXIDES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF MATRIX LABORATORIES LIMITED (IN) 2011-07-28 US disclosed
EP-2342193-A2 NOVEL COMPOUNDS FOR PRODUCING SUBSTITUTED SULFOXIDES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Matrix Laboratories Limited (IN) 2011-07-13 EP disclosed
WO-2010035283-A2 NOVEL COMPOUNDS FOR PRODUCING SUBSTITUTED SULFOXIDES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF MATRIX LABORATORIES LIMITED (IN) 2010-04-01 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 (2 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-20130231486-A1 COMPOUNDS FOR PRODUCING SUBSTITUTED SULFOXIDES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF SQOR, SMOX, CBS TSHR 3643/4885MAPK1 2238/4885ALDH1A1 248/4885
US-20110184182-A1 COMPOUNDS FOR PRODUCING SUBSTITUTED SULFOXIDES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF SQOR, SMOX, CBS TSHR 3643/4885MAPK1 2238/4885ALDH1A1 248/4885

“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.