SCHEMBL1615136

SCHEMBL1615136

CCCCCCCCCCCCCCCC1=CC=C(OC)C(O)(OC)C1O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 14/20 0.33
PTGS2 P35354 4/20 0.33
GBA1 P04062 1/20 0.33
DNTT P04053 2/20 0.32
POLB P06746 2/20 0.32
POLA1 P09884 2/20 0.32
TYR P14679 1/20 0.32
MPEG1 Q2M385 3/20 0.31

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
Heptane SCHEMBL447146 0.52 TSHR (0.73)
Octane SCHEMBL4441366 0.52 TSHR (0.73)
Hexadecane SCHEMBL27375271 0.52 TSHR (0.73)
Decane SCHEMBL3182487 0.52 TSHR (0.73)
Undecane SCHEMBL28043835 0.52 TSHR (0.73)
Octane SCHEMBL26632661 0.51
SCHEMBL17008157 0.50 TSHR (0.57) PTGS2
SCHEMBL23849704 0.50 ESR1 (0.77) PTGS2
Decane SCHEMBL11227696 0.49 TSHR (0.80)
Nonane SCHEMBL11226977 0.49 TSHR (0.80)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3274322-B1 STABLE COMPOSITIONS FOR PREVENTION / PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS THE UNIV OF MISSISSIPPI (US) 2024-08-14 EP disclosed
US-10322103-B2 Compositions for prevention/prophylactic treatment of poison ivy dermatitis UNIVERSITY OF MISSISSIPPI (US) 2019-06-18 US disclosed
US-20180078520-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS UNIVERSITY OF MISSISSIPPI 2018-03-22 US disclosed
EP-3274322-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS The University Of Mississippi (US) 2018-01-31 EP disclosed
WO-2016160090-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS THE UNIVERSITY OF MISSISSIPPI (US) 2016-10-06 WO disclosed
US-9408822-B2 Compositions for prevention/prophylactic treatment of poison ivy dermatitis THE UNIVERSITY OF MISSISSIPPI (US) 2016-08-09 US disclosed
US-20150202176-A1 Compositions for Prevention/Prophylactic Treatment of Poison Ivy Dermatitis THE UNIVERSITY OF MISSISSIPPI 2015-07-23 US disclosed
US-9029417-B2 Compositions for prevention/prophylactic treatment of poison ivy dermatitis THE UNIVERSITY OF MISSISSIPPI (US) 2015-05-12 US disclosed
US-20130303582-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS THE UNIVERSITY OF MISSISSIPPI 2013-11-14 US disclosed
US-8486998-B2 Compositions for prevention/prophylactic treatment of poison ivy dermatitis THE UNIVERSITY OF MISSISSIPPI (US) 2013-07-16 US disclosed
US-20110086900-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS THE UNIVERSITY OF MISSISSIPPI 2011-04-14 US disclosed
WO-2009146131-A2 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS THE UNIVERSITY OF MISSISSIPPI (US) 2009-12-03 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 (5 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-20130303582-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS UGT1A3, IL33, ITCH ALOX5 103/4885PTGS2 883/4885GBA1 2397/4885
US-20150202176-A1 Compositions for Prevention/Prophylactic Treatment of Poison Ivy Dermatitis UGT1A3, IL33, ITCH ALOX5 103/4885PTGS2 883/4885GBA1 2397/4885
US-20180078520-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS UGT1A3, ITCH, UGT1A1 ALOX5 146/4885PTGS2 1062/4885GBA1 3154/4885
US-10322103-B2 Compositions for prevention/prophylactic treatment of poison ivy dermatitis UGT1A3, ITCH, UGT1A1 ALOX5 146/4885PTGS2 1062/4885GBA1 3154/4885
US-20110086900-A1 COMPOSITIONS FOR PREVENTION/PROPHYLACTIC TREATMENT OF POISON IVY DERMATITIS UGT1A3, IL33, ITCH ALOX5 103/4885PTGS2 883/4885GBA1 2397/4885

“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.