Butane

Butane

SCHEMBL5143633

C=CC(=O)OCCCCCC.CCCC

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.81
HPGD P15428 1/20 0.81
ALDH1A1 P00352 3/20 0.76
CYP3A4 P08684 1/20 0.76
HCAR2 Q8TDS4 3/20 0.59
ATM Q13315 1/20 0.55
NAAA Q02083 1/20 0.53
TP53 P04637 2/20 0.52
HIF1A Q16665 2/20 0.52
HSD17B10 Q99714 1/20 0.52
EPHX1 P07099 1/20 0.50
THRB P10828 1/20 0.47
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
FAAH O00519 1/20 0.44

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
SCHEMBL10868277 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL811560 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL14574685 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL16669730 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL14967 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL877669 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL7647533 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL21218910 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL22607678 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL9442075 0.98 TSHR (0.84) TSHRHPGDALDH1A1CYP3A4HCAR2

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
CN-106699980-A Novel organic glass 林侨中 2017-05-24 CN disclosed
US-20070221024-A1 Sheet material cutting apparatus for cutting thermal imaging material FUJIFILM CORPORATION 2007-09-27 US disclosed
US-7182008-B2 Sheet material cutting method for cutting thermal imaging material FUJI PHOTO FILM CO., LTD. (JP) 2007-02-27 US disclosed
EP-1541301-A2 Sheet material cutting method for cutting a thermal imaging material and sheet material cutting apparatus for cutting a band-shaped thermal imaging material FUJI PHOTO FILM CO., LTD. (JP) 2005-06-15 EP disclosed
US-20030197298-A1 Deformation correcting method, cutting method, deformation correcting apparatus and cutting apparatus for sheet materials FUJI PHOTO FILM CO., LTD. 2003-10-23 US disclosed
US-6613253-B1 Deformation correcting method, cutting method, deformation correcting apparatus and cutting apparatus for sheet materials FUJI PHOTO FILM CO., LTD. (JP) 2003-09-02 US disclosed
EP-1088644-A2 Deformation correcting method, cutting method, deformation correcting apparatus and cutting apparatus for sheet materials FUJI PHOTO FILM CO., LTD. (JP) 2001-04-04 EP disclosed