Butane

Butane

SCHEMBL8628663

CCCC.CCCC.CCCC.CCCC.CCCC

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.50
LMNA P02545 1/20 0.50
THRB P10828 1/20 0.44
ALDH1A1 P00352 4/20 0.38
SLC22A1 O15245 3/20 0.36
TDP1 Q9NUW8 2/20 0.33
SLC22A2 O15244 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NFKB1 P19838 1/20 0.30
KCNA1 Q09470 1/20 0.30
TP53 P04637 1/20 0.30

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
Butane SCHEMBL1734106 1.00
Butane SCHEMBL3593 1.00
Butane SCHEMBL9292387 1.00 TSHR (0.50) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL2470336 1.00 TSHR (0.50) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL814744 0.91
Butane SCHEMBL7457770 0.91 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL1003138 0.91 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL3181484 0.91
Butane SCHEMBL250788 0.91
Butane SCHEMBL4483531 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3237468-A1 POLYETHYLENE FOR PIPES Norner Verdandi AS (NO) 2017-11-01 EP disclosed
WO-2016102513-A1 POLYETHYLENE FOR PIPES NORNER VERDANDI AS (NO) 2016-06-30 WO disclosed
US-5763668-A Process for aminating a mixture obtained in cracking a mineral oil fraction with ammonia or a primary or secondary amine over specific heterogeneous catalysts BASF AKTIENGESELLSCHAFT (DE) 1998-06-09 US disclosed