Pentadecane

Pentadecane

SCHEMBL11413596

CCCCCCCCCCCCCCC.O=S(=O)(O)O.[NaH]

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Pentadecane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.54
TSHR P16473 2/20 0.53
THRB P10828 1/20 0.53
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
FAAH O00519 2/20 0.50
PPARA Q07869 2/20 0.50
EPHX1 P07099 2/20 0.48
CES2 O00748 3/20 0.48
CES1 P23141 3/20 0.48
LMNA P02545 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
Tetradecane SCHEMBL23186 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Sulfuric Acid SCHEMBL29238027 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Hexadecane SCHEMBL11418243 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Octane SCHEMBL1531331 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Decane SCHEMBL3962533 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Heptane SCHEMBL25209213 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Decane SCHEMBL13370386 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Sulfuric Acid SCHEMBL11415405 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Dodecane SCHEMBL21806102 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2
Dodecane SCHEMBL534861 1.00 TP53 (0.54) TP53TSHRTHRBCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024106407-A1 COMPOSITION CONTAINING POLYMER PARTICLES AND PRODUCTION METHOD FOR COMPOSITION CONTAINING POLYMER PARTICLES キリンホールディングス株式会社 2024-05-23 WO disclosed
US-11891494-B2 Antimicrobial resin and coating material KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2024-02-06 US disclosed
EP-3760193-B9 INTRACELLULAR DELIVERY VEHICLE KIRIN HOLDINGS KK (JP) 2023-11-01 EP disclosed
EP-3760193-B1 INTRACELLULAR DELIVERY VEHICLE KIRIN HOLDINGS KK (JP) 2023-07-05 EP disclosed
US-11452697-B2 Intracellular delivery vehicle KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2022-09-27 US disclosed
US-20210363323-A1 ANTIMICROBIAL RESIN AND COATING MATERIAL KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2021-11-25 US disclosed
EP-3785541-A1 ANTIMICROBIAL RESIN AND COATING MATERIAL KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2021-03-03 EP disclosed
EP-3760193-A1 INTRACELLULAR DELIVERY VEHICLE Kirin Holdings Kabushiki Kaisha (JP) 2021-01-06 EP disclosed
US-20200309782-A1 INTRACELLULAR DELIVERY VEHICLE KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2020-10-01 US disclosed
EP-3348648-B1 INTRACELLULAR DELIVERY VEHICLE KIRIN HOLDINGS KK (JP) 2020-08-19 EP disclosed
US-10712346-B2 Intracellular delivery vehicle KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2020-07-14 US disclosed
US-20190137503-A1 INTRACELLULAR DELIVERY VEHICLE KIRIN KABUSHIKI KAISHA (JP) 2019-05-09 US disclosed
CN-108350479-A INTRACELLULAR DELIVERY VEHICLE 麒麟株式会社 2018-07-31 CN disclosed
EP-3348648-A1 INTRACELLULAR DELIVERY VEHICLE Kirin Kabushiki Kaisha (JP) 2018-07-18 EP disclosed
EP-2514771-A1 RESIN MODIFIER Kao Corporation (JP) 2012-10-24 EP disclosed
US-4235752-A IMPROVED DISHWASHING COMPOSITIONS LEVER BROTHERS COMPANY (US) 1980-11-25 US 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 (6 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-20210363323-A1 ANTIMICROBIAL RESIN AND COATING MATERIAL CROCC, CLASP1, CAD TP53 4580/4885TSHR 4216/4885THRB 4278/4885
US-10712346-B2 Intracellular delivery vehicle CHERP, ACTB, GOLT1B TP53 110/4885TSHR 3357/4885THRB 2723/4885
US-11452697-B2 Intracellular delivery vehicle CHERP, ACTB, GOLT1B TP53 110/4885TSHR 3357/4885THRB 2723/4885
US-20200309782-A1 INTRACELLULAR DELIVERY VEHICLE CHERP, ACTB, GOLT1B TP53 110/4885TSHR 3357/4885THRB 2723/4885
US-11891494-B2 Antimicrobial resin and coating material CROCC, CLASP1, CAD TP53 4580/4885TSHR 4216/4885THRB 4278/4885
US-20190137503-A1 INTRACELLULAR DELIVERY VEHICLE CHERP, ACTB, GOLT1B TP53 110/4885TSHR 3357/4885THRB 2723/4885

“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.