SCHEMBL585190

SCHEMBL585190

CC(C)CCCC(C)CCCC=O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
BLM P54132 1/20 0.48
PTPN1 P18031 3/20 0.42
MEN1 O00255 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
KMT2A Q03164 1/20 0.42
HIF1A Q16665 1/20 0.41
TSHR P16473 2/20 0.40
FAAH O00519 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
PTPN2 P17706 1/20 0.33
CDC25B P30305 1/20 0.33

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
SCHEMBL28922962 1.00 LMNA (0.59) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL18092218 0.93 LMNA (0.64) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL316430 0.91 LMNA (0.59) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL1782837 0.91 LMNA (0.46) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL276587 0.91 LMNA (0.59) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL231303 0.90
SCHEMBL21975301 0.88 LMNA (0.64) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL11764950 0.86 LMNA (0.59) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL3408019 0.85 HIF1A (0.45) LMNABLMALOX15HIF1ATSHR
Propane SCHEMBL1390068 0.85 TSHR (0.50) LMNABLMHIF1ATSHRFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2072083-B1 Utilisation of 2.4'-dimethyl-propiophenon as an aroma SYMRISE AG (DE) 2012-02-15 EP claimed
US-20090162308-A1 USE OF 2,4'-DIMETHYLPROPIOPHENONE AS A FRAGRANCE SUBSTANCE SYMRISE GMBH & CO. KG (DE) 2009-06-25 US claimed
EP-2072083-A1 Utilisation of 2.4'-dimethyl-propiophenon as an aroma Symrise GmbH & Co. KG (DE) 2009-06-24 EP claimed
US-20060166857-A1 4,8-Dimethyl-7-nonen-2-one and 4,8-dimethylnonan-2-one used as perfumes SYMRISE GMBH & CO. KG (DE) 2006-07-27 US claimed
EP-1682230-A1 4,8-DIMETHYL-7-NONEN-2-ONE AND 4,8-DIMETHYLNONAN-2-ONE USED AS PERFUMES Symrise GmbH & Co. KG (DE) 2006-07-26 EP claimed
WO-2005004825-A1 4,8-DIMETHYL-7-NONEN-2-ONE AND 4,8-DIMETHYLNONAN-2-ONE USED AS PERFUMES SYMRISE GMBH & CO. KG (DE) 2005-01-20 WO claimed
CN-106010788-B Novel aldehyde compounds and their use in perfuming compositions 国际香料和香精公司 2021-04-23 CN disclosed
US-10150722-B2 Aldehyde compounds and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2018-12-11 US disclosed
EP-3072876-B1 ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INT FLAVORS & FRAGRANCES INC (US) 2018-10-10 EP disclosed
US-20180057436-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2018-03-01 US disclosed
US-20180057436-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2018-03-01 US disclosed
US-9850191-B2 Aldehyde compounds and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2017-12-26 US disclosed
US-9850191-B2 Aldehyde compounds and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2017-12-26 US disclosed
EP-3072876-A1 ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS Closson, Adam P. (US) 2016-09-28 EP disclosed
EP-2072083-B1 Utilisation of 2.4'-dimethyl-propiophenon as an aroma SYMRISE AG (DE) 2012-02-15 EP disclosed
US-20090162308-A1 USE OF 2,4'-DIMETHYLPROPIOPHENONE AS A FRAGRANCE SUBSTANCE SYMRISE GMBH & CO. KG (DE) 2009-06-25 US disclosed
EP-2072083-A1 Utilisation of 2.4'-dimethyl-propiophenon as an aroma Symrise GmbH & Co. KG (DE) 2009-06-24 EP disclosed
US-20060166857-A1 4,8-Dimethyl-7-nonen-2-one and 4,8-dimethylnonan-2-one used as perfumes SYMRISE GMBH & CO. KG (DE) 2006-07-27 US disclosed
EP-1682230-A1 4,8-DIMETHYL-7-NONEN-2-ONE AND 4,8-DIMETHYLNONAN-2-ONE USED AS PERFUMES Symrise GmbH & Co. KG (DE) 2006-07-26 EP disclosed
WO-2005004825-A1 4,8-DIMETHYL-7-NONEN-2-ONE AND 4,8-DIMETHYLNONAN-2-ONE USED AS PERFUMES SYMRISE GMBH & CO. KG (DE) 2005-01-20 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 (3 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-20090162308-A1 USE OF 2,4'-DIMETHYLPROPIOPHENONE AS A FRAGRANCE SUBSTANCE CYP1B1, CYP4A22, ROS1 LMNA 4524/4885BLM 4734/4885PTPN1 3247/4885
US-20180057436-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS ALDH1A1, TRPA1, ALDH2 LMNA 4040/4885BLM 4671/4885PTPN1 4833/4885
US-10150722-B2 Aldehyde compounds and their use in perfume compositions ALDH1A1, ALDH2, ADH5 LMNA 3615/4885BLM 4663/4885PTPN1 4802/4885

“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.