SCHEMBL5175641

SCHEMBL5175641

COc1nccnc1CCCC(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.33
HRH1 P35367 4/20 0.33
CHRM1 P11229 3/20 0.33
KCNH2 Q12809 3/20 0.33
AAK1 Q2M2I8 1/20 0.32
CYP19A1 P11511 1/20 0.31
GPR84 Q9NQS5 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
SCHEMBL30149469 1.00 CYP2D6 (0.33) CYP2D6HRH1CHRM1KCNH2AAK1
SCHEMBL28229981 0.79 CCNB2 (0.36) CYP2D6HRH1CHRM1KCNH2
SCHEMBL997911 0.79 CYP2D6 (0.39) CYP2D6HRH1CHRM1KCNH2CYP19A1
SCHEMBL674404 0.78 CYP2D6 (0.38) CYP2D6HRH1CHRM1KCNH2CYP19A1
SCHEMBL29466583 0.77 TRPM8 (0.39) CYP2D6HRH1CHRM1KCNH2
SCHEMBL113424 0.77 TRPM8 (0.39) CYP2D6HRH1CHRM1KCNH2
SCHEMBL20873451 0.76 CCNB2 (0.39) CYP2D6KCNH2GPR84
SCHEMBL2581673 0.75 CYP2D6 (0.37) CYP2D6HRH1CHRM1KCNH2
SCHEMBL28249387 0.73 PDE3B (0.37) CYP2D6HRH1CHRM1KCNH2
SCHEMBL13939867 0.72 CYP11B1 (0.41) CYP2D6HRH1CHRM1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250163343-A1 FRAGRANCE COMPOSITIONS FOR SLEEP IMPROVEMENT INTERNATIONAL FLAVORES & FRAGRANCES INC. 2025-05-22 US claimed
CN-119486703-A Fragrance composition with lasting fragrance appearance 弗门尼舍有限公司 2025-02-18 CN claimed
US-11365370-B2 Fragrance compositions THE PROCTER & GAMBLE COMPANY (US) 2022-06-21 US claimed
US-20200048578-A1 ORGANIC COMPOUNDS GIVAUDAN S.A. (CH) 2020-02-13 US claimed
US-9949911-B2 Antiperspirant and deodorant compositions THE PROCTER & GAMBLE COMPANY (US) 2018-04-24 US claimed
US-20180051231-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2018-02-22 US claimed
EP-3271443-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2018-01-24 EP claimed
US-20170312204-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS PROCTER & GAMBLE (US) 2017-11-02 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
WO-2016146673-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2016-09-22 WO 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-2931234-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS The Procter and Gamble Company (US) 2015-10-21 EP claimed
EP-2931236-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS The Procter & Gamble Company (US) 2015-10-21 EP claimed
US-20140179722-A1 Antiperspirant and Deodorant Compositions THE PROCTER & GAMBLE COMPANY (US) 2014-06-26 US claimed
US-20140170194-A1 FRAGRANCE MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 US claimed
WO-2014093819-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed
US-20140170101-A1 Antiperspirant and Deodorant Compositions THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 US claimed
WO-2014093747-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed

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-20140170101-A1 Antiperspirant and Deodorant Compositions LPO, GPX4, DEK CYP2D6 287/4885HRH1 442/4885CHRM1 2662/4885
US-20170312204-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS LPO, GPX4, DEK CYP2D6 287/4885HRH1 442/4885CHRM1 2662/4885

“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.