SCHEMBL1308539

SCHEMBL1308539

CCCCCC1OCCC(CCC)S1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.48
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 3/20 0.34
SPHK1 Q9NYA1 5/20 0.33
SPHK2 Q9NRA0 4/20 0.33
ALOX5 P09917 2/20 0.33
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL18339141 1.00 EPHX1 (0.48) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL18339140 1.00 EPHX1 (0.48) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL11241826 0.98 EPHX1 (0.52) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL11255010 0.98 EPHX1 (0.52) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL11251244 0.93 EPHX1 (0.53) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL11245616 0.84 EPHX1 (0.52) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL11251253 0.83 EPHX1 (0.35) EPHX1
SCHEMBL28581095 0.81 ALDH1A1 (0.45) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL28238221 0.81 ALDH1A1 (0.45) EPHX1ALDH1A1CYP1A2SPHK1SPHK2
SCHEMBL1306960 0.79 EPHX1 (0.31) EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200146960-A1 Antiperspirant and Deodorant Compositions PROCTER & GAMBLE (US) 2020-05-14 US claimed
US-10568825-B2 Antiperspirant and deodorant compositions THE PROCTER & GAMBLE COMPANY (US) 2020-02-25 US claimed
US-20170267944-A1 FRAGRANCE COMPOSITIONS PROCTER & GAMBLE (US) 2017-09-21 US claimed
EP-3139902-A2 FRAGRANCE COMPOSITIONS The Procter & Gamble Company (US) 2017-03-15 EP claimed
US-20150322376-A1 Fragrance Compositions THE PROCTER & GAMBLE COMPANY 2015-11-12 US claimed
WO-2015171738-A2 FRAGRANCE COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2015-11-12 WO claimed
EP-2931235-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS The Procter & Gamble Company (US) 2015-10-21 EP claimed
EP-2931238-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS The Procter & Gamble Company (US) 2015-10-21 EP claimed
EP-2931854-A1 FRAGRANCE MATERIALS The Procter & Gamble Company (US) 2015-10-21 EP claimed
US-20140179748-A1 Antiperspirant and Deodorant Compositions THE PROCTER & GAMBLE COMPANY (US) 2014-06-26 US claimed
US-20140170102-A1 Antiperspirant and Deodorant Compositions THE PROCTER & GAMBLE COMAPNY (US) 2014-06-19 US claimed
WO-2014093828-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed
US-20140170194-A1 FRAGRANCE MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 US claimed
WO-2014093748-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed
WO-2014093807-A1 FRAGRANCE MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed
US-12636240-B2 Antiperspirant composition COTY INC. (US) 2026-05-26 US disclosed
US-12533302-B2 Systems and methods for delivery of actives and healing tissue VIAS PARTNERS, LLC 2026-01-27 US disclosed
US-4364400-A 1,3-OXATHIANE AND 1,3-OXATHIOLANE DERIVATIVES FIRMENICH SA (CH) 1982-12-21 US disclosed
US-4262030-A 1,3-OXATHIANE AND 1,3-OXATHIOLANE DERIVATIVES FIRMENICH SA (CH) 1981-04-14 US disclosed
US-4220561-A Oxathiane and oxathiolane derivatives as perfuming agents FIRMENICH SA (CH) 1980-09-02 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 (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-10568825-B2 Antiperspirant and deodorant compositions DEK, QDPR, GPX4 EPHX1 867/4885ALDH1A1 726/4885CYP1A2 875/4885
US-20140170102-A1 Antiperspirant and Deodorant Compositions DEK, QDPR, GPX4 EPHX1 867/4885ALDH1A1 726/4885CYP1A2 875/4885
US-12533302-B2 Systems and methods for delivery of actives and healing tissue EXOSC10, PDGFA, EXOSC9 EPHX1 2941/4885ALDH1A1 2173/4885CYP1A2 4537/4885
US-20200146960-A1 Antiperspirant and Deodorant Compositions DEK, QDPR, GPX4 EPHX1 867/4885ALDH1A1 726/4885CYP1A2 875/4885
US-12636240-B2 Antiperspirant composition OPRD1, DRD2, TAS2R40 EPHX1 1562/4885ALDH1A1 1619/4885CYP1A2 543/4885

“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.