Butane

Butane

SCHEMBL888582

CC(C)COC(=O)CC(=O)OCC(C)C.CCCC

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.50
GAA P10253 2/20 0.50
MGAM O43451 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PPARG P37231 1/20 0.37
NCOA2 Q15596 1/20 0.37
NCOA1 Q15788 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 2/20 0.37
CYP3A4 P08684 1/20 0.37
ATM Q13315 1/20 0.37
KDM4E B2RXH2 2/20 0.36

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 SCHEMBL9052819 0.94 GAA (0.62) TSHRGAAMGAMSIMGAM2
SCHEMBL243431 0.93 TSHR (0.56) TSHRGAAMGAMSIMGAM2
SCHEMBL28235998 0.91 TSHR (0.50) TSHRGAAMGAMSIMGAM2
Butane SCHEMBL5526854 0.89 TSHR (0.41) TSHRGAAMGAMSIMGAM2
SCHEMBL6740870 0.88 GAA (0.68) TSHRGAAMGAMSIMGAM2
SCHEMBL28236036 0.88 TSHR (0.52) TSHRGAAMGAMSIMGAM2
SCHEMBL27964667 0.88 TSHR (0.52) TSHRGAAMGAMSIMGAM2
SCHEMBL28862575 0.86 TSHR (0.47) TSHRGAAMGAMSIMGAM2
SCHEMBL21925523 0.86 GAA (0.65) TSHRGAAMGAMSIMGAM2
SCHEMBL5859550 0.86 TSHR (0.50) TSHRGAAMGAMSIMGAM2

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116769148-A Water-based polyester, and preparation method and application thereof 苏州瀚海新材料有限公司 2023-09-19 CN claimed
CN-117964486-A Production method of diethyl isobutyl malonate 潍坊晶润化工有限公司 2024-05-03 CN disclosed
CN-116769148-A Water-based polyester, and preparation method and application thereof 苏州瀚海新材料有限公司 2023-09-19 CN disclosed
CN-115515987-A Solid catalyst component for olefin polymerization and process for producing the same, catalyst for olefin polymerization and process for producing the same, and process for producing olefin polymer 东邦钛株式会社 2022-12-23 CN disclosed
CN-115515988-A Solid catalyst component for olefin polymerization, catalyst for olefin polymerization, and process for producing olefin polymer 东邦钛株式会社 2022-12-23 CN disclosed
CN-112661883-B Solid catalyst component for preparing polyolefin, catalyst system and application thereof 中国石油化工股份有限公司 2022-10-21 CN disclosed
CN-111234070-B Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2022-03-01 CN disclosed
CN-111234073-B Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2021-12-31 CN disclosed
CN-111234072-B Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2021-12-31 CN disclosed
CN-108779056-B Magnesium alkoxide, process for producing magnesium alkoxide, solid catalyst component for olefin polymerization, catalyst for olefin polymerization, and process for producing olefin polymer 东邦钛株式会社 2021-12-24 CN disclosed
EP-1921093-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST AND METHOD FOR PRODUCING OLEFIN POLYMER BY USING SAME Toho Catalyst Co., Ltd. (JP) 2008-05-14 EP disclosed
US-7208435-B2 Solid catalyst component for olefin polymerization and catalyst TOHO CATALYST CO., LTD. (JP) 2007-04-24 US 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-20050227856-A1 Solid catalyst component for olefin polymerization and catalyst TOHO CATALYST CO., LTD. (JP) 2005-10-13 US disclosed
EP-1533322-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST Toho Catalyst Co., Ltd. (JP) 2005-05-25 EP disclosed
US-20050032991-A1 Olefin polymerization catalyst TOHO CATALYST CO, LTD. (JP) 2005-02-10 US disclosed
EP-0385765-A2 Process for polymerizing olefins and catalyst for polymerizing olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-09-05 EP disclosed
EP-0282341-A1 Process for polymerization of olefins and polymerization catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-09-14 EP disclosed