Pentane

Pentane

SCHEMBL2525553

CCCCC.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.64
LMNA P02545 3/20 0.64
THRB P10828 1/20 0.46
ALDH1A1 P00352 4/20 0.38
TDP1 Q9NUW8 1/20 0.38
SLC22A1 O15245 3/20 0.35
SLC22A2 O15244 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DNM1 Q05193 4/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
Pentane SCHEMBL1825700 0.96 TSHR (0.58) TSHRLMNATHRBALDH1A1TDP1
Pentane SCHEMBL3094656 0.96 TSHR (0.58) TSHRLMNATHRBALDH1A1TDP1
Hexane SCHEMBL29124909 0.91 TSHR (0.58) TSHRLMNATHRBALDH1A1SLC22A1
Hexane SCHEMBL27826796 0.91 TSHR (0.58) TSHRLMNATHRBALDH1A1SLC22A1
Heptane SCHEMBL28681950 0.87 TSHR (0.67) TSHRLMNATHRBALDH1A1SLC22A1
Undecane SCHEMBL28453375 0.87 TSHR (0.67) TSHRLMNATHRBALDH1A1SLC22A1
Undecane SCHEMBL27865572 0.87 TSHR (0.67) TSHRLMNATHRBALDH1A1SLC22A1
Octane SCHEMBL27624 0.87 TSHR (0.67) TSHRLMNATHRBALDH1A1SLC22A1
Octane SCHEMBL27625 0.87 TSHR (0.67) TSHRLMNATHRBALDH1A1SLC22A1
Heptane SCHEMBL28458543 0.87 TSHR (0.67) TSHRLMNATHRBALDH1A1SLC22A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111163809-B Transglutaminase conjugation method and linker 保罗·谢勒学院 2024-07-02 CN claimed
CN-118159298-A Method for producing antibody-linker conjugates 阿拉里斯生物技术股份公司 2024-06-07 CN claimed
WO-2024086246-A2 2-SUBSTITUTED 3,4 A, 5, 7, 8, 8 A-HEXAHYDRO-4H-THIOP YRANO [4,3- DJPYRIMIDIN-4-ONES FOR WOUND TREATMENT Eluciderm Inc. (US) 2024-04-25 WO claimed
CN-116801910-A Means and methods for producing antibody-linker conjugates 阿拉里斯生物技术股份公司 2023-09-22 CN claimed
CN-116406302-A Method of transglutaminase conjugation with amino acid based linkers 阿拉里斯生物技术股份公司 2023-07-07 CN claimed
CN-113613679-A Transglutaminase conjugation methods for glycine-based linkers 保罗·谢勒学院 2021-11-05 CN claimed
CN-111163809-A Transglutaminase conjugation methods and linkers 保罗·谢勒学院 2020-05-15 CN claimed
EP-3632920-A1 METHODS FOR PREPARING BRIDGED BI-AROMATIC LIGANDS Univation Technologies, LLC (US) 2020-04-08 EP claimed
EP-3285923-B1 BRIDGED BI-AROMATIC LIGANDS AND OLEFIN POLYMERIZATION CATALYSTS PREPARED THEREFROM UNIVATION TECH LLC (US) 2019-07-17 EP claimed
US-10195589-B2 Bridged bi-aromatic ligands and olefin polymerization catalysts prepared therefrom UNIVATION TECHNOLOGIES, LLC (US) 2019-02-05 US claimed
CN-109232204-A A kind of synthetic method without transition metal-catalyzed diarylethene 绍兴文理学院 2019-01-18 CN claimed
US-20180147562-A1 BRIDGED BI-AROMATIC LIGANDS AND OLEFIN POLYMERIZATION CATALYSTS PREPARED THEREFROM UNIVATION TECHNOLOGIES, LLC (US) 2018-05-31 US claimed
EP-3285923-A1 BRIDGED BI-AROMATIC LIGANDS AND OLEFIN POLYMERIZATION CATALYSTS PREPARED THEREFROM Univation Technologies, LLC (US) 2018-02-28 EP claimed
WO-2016172097-A1 BRIDGED BI-AROMATIC LIGANDS AND OLEFIN POLYMERIZATION CATALYSTS PREPARED THEREFROM UNIVATION TECHNOLOGIES, LLC (US) 2016-10-27 WO claimed
CN-111163809-B Transglutaminase conjugation method and linker 保罗·谢勒学院 2024-07-02 CN disclosed
CN-118159298-A Method for producing antibody-linker conjugates 阿拉里斯生物技术股份公司 2024-06-07 CN disclosed
WO-2024086246-A2 2-SUBSTITUTED 3,4 A, 5, 7, 8, 8 A-HEXAHYDRO-4H-THIOP YRANO [4,3- DJPYRIMIDIN-4-ONES FOR WOUND TREATMENT Eluciderm Inc. (US) 2024-04-25 WO disclosed
WO-2008119162-A1 METHODS OF PREPARING PRIMARY, SECONDARY AND TERTIARY CARBINAMINE COMPOUNDS IN THE PRESENCE OF AMMONIA KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2008-10-09 WO disclosed
WO-2008021029-A2 PROCESS FOR MAKING LACTAM TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2008-02-21 WO disclosed
WO-2008021926-A2 MODULATORS OF GLUCOCORTICOID RECEPTOR, AND/OR AP-1, AND/OR NF-KB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10195589-B2 Bridged bi-aromatic ligands and olefin polymerization catalysts prepared therefrom WASF2, WEE2, PICALM TSHR 4569/4885LMNA 4204/4885THRB 4552/4885
US-20180147562-A1 BRIDGED BI-AROMATIC LIGANDS AND OLEFIN POLYMERIZATION CATALYSTS PREPARED THEREFROM WASF2, WEE2, PICALM TSHR 4569/4885LMNA 4204/4885THRB 4552/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.