Butane

Butane

SCHEMBL1865336

CCCC.CCCCC/C(C=O)=C/c1ccccc1

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.97
TDP1 Q9NUW8 1/20 0.94
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
AKR1C3 P42330 1/20 0.42
ELANE P08246 1/20 0.40
EGFR P00533 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX2 P34913 1/20 0.40
TUBB4A P04350 2/20 0.39
TUBB P07437 2/20 0.39
TUBA3C P0DPH7 2/20 0.39
TUBA1B P68363 2/20 0.39
TUBA4A P68366 2/20 0.39
TUBB4B P68371 2/20 0.39
TUBB3 Q13509 2/20 0.39
TUBB2A Q13885 2/20 0.39

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 SCHEMBL1773800 1.00 LMNA (0.97) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL113319 0.98 LMNA (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL12469222 0.98 LMNA (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL147065 0.98 LMNA (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL113320 0.98 LMNA (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL901344 0.98 LMNA (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL2941510 0.97 TDP1 (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL10964293 0.97 TDP1 (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL113170 0.97 TDP1 (1.00) LMNATDP1ALDH1A1TSHRCES2
SCHEMBL113171 0.97 TDP1 (1.00) LMNATDP1ALDH1A1TSHRCES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3197424-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP disclosed
WO-2017070132-A1 ARRAY OF FABRIC TREATMENT PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2017-04-27 WO disclosed
WO-2016049398-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed
EP-2496682-A1 DELIVERY PARTICLE The Procter & Gamble Company (US) 2012-09-12 EP disclosed
WO-2011056935-A1 DELIVERY PARTICLE THE PROCTER & GAMBLE COMPANY (US) 2011-05-12 WO disclosed