Methane

Methane

SCHEMBL6569490

C.C.NC(=S)OCc1ccccc1.NC(O)=S

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.57
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
CA9 Q16790 3/20 0.57
ALDH1A1 P00352 4/20 0.48
TDP1 Q9NUW8 2/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
IDO1 P14902 1/20 0.46
AGXT P21549 1/20 0.45
TSHR P16473 1/20 0.44
LMNA P02545 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
FABP7 O15540 1/20 0.41
FABP5 Q01469 1/20 0.41

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 SCHEMBL11212880 1.00 CA12 (0.57) CA12CA1CA2CA9ALDH1A1
SCHEMBL2773503 0.98 CA12 (0.59) CA12CA1CA2CA9ALDH1A1
Benzene SCHEMBL29116606 0.98 CA12 (0.59) CA12CA1CA2CA9ALDH1A1
SCHEMBL23878412 0.96 CA12 (0.57) CA12CA1CA2CA9ALDH1A1
SCHEMBL448070 0.96 CA12 (0.57) CA12CA1CA2CA9ALDH1A1
Ammonia Solution, Strong SCHEMBL23878452 0.96 CA12 (0.57) CA12CA1CA2CA9ALDH1A1
SCHEMBL702199 0.96 CA12 (0.61) CA12CA1CA2CA9ALDH1A1
SCHEMBL3367103 0.96 CA12 (0.61) CA12CA1CA2CA9ALDH1A1
Ethane SCHEMBL5931998 0.94 CA12 (0.55) CA12CA1CA2CA9ALDH1A1
Ammonia Solution, Strong SCHEMBL23878422 0.94 CA12 (0.59) CA12CA1CA2CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265499-B1 POLYMERIZING MIXTURE MENICON CO., LTD. (JP) 2001-07-24 US claimed
US-4086226-A REACTING DITHIOCARBAMATES WITH DIMETHYLSULPHOXIDE AND IODINE CATALYST MONTEDISON S.P.A. (IT) 1978-04-25 US claimed
EP-0921134-B1 Process for producing a shaped product MENICON CO LTD (JP) 2004-04-07 EP disclosed
EP-0814095-B1 Process for producing a shaped product MENICON CO LTD (JP) 2001-10-24 EP disclosed
US-6265499-B1 POLYMERIZING MIXTURE MENICON CO., LTD. (JP) 2001-07-24 US disclosed
EP-0921134-A1 Process for producing a shaped product Menicon Co., Ltd. (JP) 1999-06-09 EP disclosed
US-5866047-A Process for producing a shaped product MENICON CO., LTD. (JP) 1999-02-02 US disclosed
EP-0814095-A2 Process for producing a shaped product Menicon Co., Ltd. (JP) 1997-12-29 EP disclosed
US-4086226-A REACTING DITHIOCARBAMATES WITH DIMETHYLSULPHOXIDE AND IODINE CATALYST MONTEDISON S.P.A. (IT) 1978-04-25 US disclosed
US-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 US disclosed