SCHEMBL1275162

SCHEMBL1275162

CCC(C)(CC(C)(C)C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.78
LMNA P02545 5/20 0.78
MEN1 O00255 4/20 0.78
TP53 P04637 4/20 0.78
KMT2A Q03164 4/20 0.78
ALDH1A1 P00352 4/20 0.78
CYP3A4 P08684 4/20 0.78
HTT P42858 4/20 0.78
TSHR P16473 3/20 0.78
TDP1 Q9NUW8 3/20 0.78
APAF1 O14727 3/20 0.78
USP2 O75604 3/20 0.78
MAPT P10636 3/20 0.78
RAD52 P43351 3/20 0.78
CHRM2 P08172 3/20 0.78
ADRA2A P08913 3/20 0.78
CHRM1 P11229 3/20 0.78
ADRA2B P18089 3/20 0.78
ADRA2C P18825 3/20 0.78
CHRM3 P20309 3/20 0.78

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
Hydrochloric Acid SCHEMBL120301 0.99 MEN1 (0.78) SMN1; SMN2LMNAMEN1TP53KMT2A
Water SCHEMBL15416925 0.99 SMN1; SMN2 (0.76) SMN1; SMN2LMNAMEN1TP53KMT2A
SCHEMBL3913464 0.90 SMN1; SMN2 (0.76) SMN1; SMN2LMNAMEN1TP53KMT2A
Benzethonium SCHEMBL122985 0.87 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMEN1TP53KMT2A
Benzethonium SCHEMBL927612 0.86 SMN1; SMN2 (0.98) SMN1; SMN2LMNAMEN1TP53KMT2A
Benzethonium SCHEMBL22711570 0.86 SMN1; SMN2 (0.98) SMN1; SMN2LMNAMEN1TP53KMT2A
Benzethonium SCHEMBL5549294 0.86 SMN1; SMN2 (0.98) SMN1; SMN2LMNAMEN1TP53KMT2A
Benzethonium SCHEMBL4418328 0.86 SMN1; SMN2 (0.98) SMN1; SMN2LMNAMEN1TP53KMT2A
Benzethonium SCHEMBL1951703 0.86 SMN1; SMN2 (0.98) SMN1; SMN2LMNAMEN1TP53KMT2A
Benzethonium SCHEMBL1672928 0.86 SMN1; SMN2 (0.98) SMN1; SMN2LMNAMEN1TP53KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2279736-A1 Microbicidal and antiparasitic compositions comprising quassinoids or quassionid-containing plant extracts Life Science Investments Ltd. (GB) 2011-02-02 EP claimed
WO-2002067898-A1 PROLONGATION OF CHEMICAL ACTIVITY OF FLAVORANTS AND THERAPEUTICS WITH CETYL PYRIDINIUM CHLORIDE SDG, INC. (US) 2002-09-06 WO claimed
EP-4422572-B1 ABSORBENT WEB AND ARTICLE SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2026-03-25 EP disclosed
EP-4422572-A1 ABSORBENT WEB AND ARTICLE Solventum Intellectual Properties Company (US) 2024-09-04 EP disclosed
US-20240016826-A1 COMPOSITION, PHARMACEUTICAL COMPOSITION, USE OF A STABLE TOPICAL COMPOSITION COMPRISING A NANOEMULSION AND OF AT LEAST ONE ANTILEISHMANIAL COMPOUND, AND METHOD FOR THE TREATMENT OF CUTANEOUS LEISHMANIASIS FUNDAÇÃO OSWALDO CRUZ (BR) 2024-01-18 US disclosed
EP-4248948-A1 COMPOSITION, PHARMACEUTICAL COMPOSITION, USE OF A STABLE TOPICAL COMPOSITION COMPRISING A NANOEMULSION AND OF AT LEAST ONE ANTILEISHMANIAL COMPOUND, AND METHOD FOR THE TREATMENT OF CUTANEOUS LEISHMANIASIS Fundação Oswaldo Cruz (BR) 2023-09-27 EP disclosed
WO-2023073497-A1 ABSORBENT WEB AND ARTICLE 3M INNOVATIVE PROPERTIES COMPANY (US) 2023-05-04 WO disclosed
US-20210254158-A1 METHOD FOR PREDICTING A SUBJECTS RESPONSE TO SLC MODULATOR THERAPY RESEARCH FOUNDATION FOR MENTAL HYGIENE, INC. 2021-08-19 US disclosed
WO-2019046303-A1 A METHOD FOR PREDICTING A SUBJECT'S RESPONSE TO SLC MODULATOR THERAPY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-03-07 WO disclosed
CN-108472617-A Include the microcapsules of polyester-urethane shell and hydrophilic nuclear material 巴斯夫欧洲公司 2018-08-31 CN disclosed
CN-108472616-A Include the microcapsules of polyester-urethane shell and hydrophobic nuclear material 巴斯夫欧洲公司 2018-08-31 CN disclosed
CN-1444471-A Cosmetic composition PROCTER & GAMBLE (US) 2003-09-24 CN disclosed
CN-1441665-A Skin care compositions containing polysilicone elastomers PROCTER & GAMBLE (US) 2003-09-10 CN disclosed
CN-1420757-A Improved stannous oral compositions PROCTER & GAMBLE (US) 2003-05-28 CN disclosed
CN-1418086-A Stable dentrifice compositions comprising polyphosphate, Fluoride, and stannous PROCTER & GAMBLE (US) 2003-05-14 CN disclosed
CN-1411343-A Chewing gum composition PROCTER & GAMBLE (US) 2003-04-16 CN disclosed
CN-1328441-A Methods of reducing astringency of stannous in dentifrice compositions PROCTER & GAMBLE (US) 2001-12-26 CN disclosed
CN-1328442-A Method for reducing staining of stannous in dentifrice compositions PROCTER & GAMBLE (US) 2001-12-26 CN disclosed
CN-1238675-A Dentifrice compositions containing polyphosphate and monofluorophosphate PROCTER & GAMBLE (US) 1999-12-15 CN disclosed
CN-1237894-A Dentifrice compositions containing polyphosphate and fluoride PROCTER & GAMBLE (US) 1999-12-08 CN disclosed