SCHEMBL29328876

SCHEMBL29328876

CCCCOC(=O)OCCCO

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
ATM Q13315 1/20 0.52
ACHE P22303 7/20 0.48
TSHR P16473 3/20 0.48
HPGD P15428 1/20 0.48
HCAR2 Q8TDS4 1/20 0.45
NAAA Q02083 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
EPHX1 P07099 1/20 0.42
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
Butyl Alcohol SCHEMBL28186017 0.95 ALDH1A1 (0.56) ALDH1A1ATMACHETSHRHPGD
Ethylene Glycol SCHEMBL9683622 0.93 ALDH1A1 (0.58) ALDH1A1ATMACHETSHRHPGD
SCHEMBL6007688 0.91 ALDH1A1 (0.56) ALDH1A1ATMACHETSHRHPGD
SCHEMBL37837 0.90 ALDH1A1 (0.67) ALDH1A1ATMACHETSHRHPGD
Fluoride SCHEMBL29068332 0.87 ALDH1A1 (0.64) ALDH1A1ATMACHETSHRHPGD
SCHEMBL28758644 0.87 ALDH1A1 (0.64) ALDH1A1ATMACHETSHRHPGD
Hydrogen Peroxide SCHEMBL28081782 0.87 ALDH1A1 (0.64) ALDH1A1ATMACHETSHRHPGD
SCHEMBL14890682 0.87 ALDH1A1 (0.64) ALDH1A1ATMACHETSHRHPGD
SCHEMBL4553342 0.87 ALDH1A1 (0.64) ALDH1A1ATMACHETSHRHPGD
Hydrogen Peroxide SCHEMBL28209879 0.87 ALDH1A1 (0.64) ALDH1A1ATMACHETSHRHPGD

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
US-20240238076-A1 PROCESS FOR PRODUCING VASCULAR PROSTHESES LUDWIG BOLTZMANN GESELLSCHAFT – ÖSTERREICHISCHE VEREINIGUNG ZUR FÖRDERUNG VON WISSENSCHAFTLICHEN FORSCHUNGEN (AT) 2024-07-18 US disclosed