Butane

Butane

SCHEMBL6048652

CC(C)OC(=O)CC(=O)OC(C)C.CCCC

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
TSHR P16473 4/20 0.43
GAA P10253 2/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
FAAH O00519 4/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
MAPT P10636 2/20 0.37
CYP2D6 P10635 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 2/20 0.36
ALOX15 P16050 2/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL229792 0.92 TSHR (0.50) LMNATSHRGAAMGAMSI
Alcohol SCHEMBL28450884 0.90 LMNA (0.50) LMNATSHRGAAMGAMSI
SCHEMBL28875912 0.89 LMNA (0.48) LMNATSHRGAAMGAMSI
SCHEMBL18152012 0.89 LMNA (0.48) LMNATSHRGAAMGAMSI
SCHEMBL28727541 0.89 LMNA (0.48) LMNATSHRGAAMGAMSI
SCHEMBL28315849 0.89 LMNA (0.48) LMNATSHRGAAMGAMSI
Butane SCHEMBL452862 0.88 LMNA (0.50) LMNATSHRGAAFAAHCNR1
SCHEMBL12111495 0.84 LMNA (0.47) LMNATSHRGAAMGAMSI
Butane SCHEMBL20558824 0.84 LMNA (0.68) LMNATSHRMAPTCYP2D6ALDH1A1
Butane SCHEMBL29166845 0.84 LMNA (0.56) LMNATSHRMAPTCYP2D6ALDH1A1

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
CN-114805647-B Catalyst composition for olefin polymerization and application thereof 北京肯佰恩科技发展有限公司 2024-03-29 CN disclosed
US-7141634-B2 Catalyst for olefin polymerization and process for polymerizing olefins TOHO CATALYST CO., LTD. (JP) 2006-11-28 US disclosed
US-6984600-B2 Olefin polymerization catalyst TOHO CATALYST CO., LTD (JP) 2006-01-10 US disclosed
US-20050250918-A1 Catalyst for olefin polymerization and process for polymerizing olefins TOHO CATALYST CO., LTD. (JP) 2005-11-10 US disclosed
US-20050032991-A1 Olefin polymerization catalyst TOHO CATALYST CO, LTD. (JP) 2005-02-10 US disclosed