Butane

Butane

SCHEMBL28597553

CCCC.CCCC.CCCC.CCCC.OB(O)O.OB(O)O.OB(O)O.OB(O)O

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
LMNA P02545 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
ANPEP P15144 1/20 0.44
ALDH1A1 P00352 2/20 0.36
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
THRB P10828 1/20 0.31
LPL P06858 1/20 0.30
LIPG Q9Y5X9 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
Boric Acid SCHEMBL14353265 0.82
Butane SCHEMBL9831053 0.80 ANPEP (0.39) TSHRANPEPALDH1A1
Pentane SCHEMBL27945067 0.80
Propanol SCHEMBL8141697 0.80
Boric Acid SCHEMBL8141309 0.78
Boric Acid SCHEMBL30818038 0.78 TSHR (0.67) TSHRLMNATDP1ANPEPALDH1A1
Butane SCHEMBL29022074 0.78
Heptane SCHEMBL23152706 0.77 TSHR (0.67) TSHRLMNAANPEPALDH1A1CES2
Propylamine SCHEMBL11574897 0.77
Boric Acid SCHEMBL31206976 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113146464-A Porous chemical mechanical polishing pad 应用材料公司 2021-07-23 CN claimed