SCHEMBL14716559

SCHEMBL14716559

C=CCCCCCCCCCC(=O)CC(C)CCC=C(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
ABCC4 O15439 1/20 0.42
ALOX15 P16050 3/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.41
USP2 O75604 3/20 0.39
GGPS1 O95749 2/20 0.39
FDPS P14324 2/20 0.39
TSHR P16473 1/20 0.38
CYP3A4 P08684 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
RECQL P46063 1/20 0.38
HPGD P15428 1/20 0.37
GLA P06280 1/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35

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
SCHEMBL5610763 1.00 MAPT (0.42) MAPTABCC4ALOX15ALDH1A1LMNA
SCHEMBL5610767 1.00 MAPT (0.42) MAPTABCC4ALOX15ALDH1A1LMNA
SCHEMBL8085626 0.89 MAPT (0.48) MAPTABCC4ALDH1A1LMNAUSP2
SCHEMBL28561180 0.86 MAPT (0.48) MAPTABCC4ALDH1A1LMNAUSP2
SCHEMBL20608591 0.83 ALOX15 (0.45) MAPTALOX15ALDH1A1USP2GGPS1
SCHEMBL2049379 0.82 MAPT (0.50) MAPTABCC4ALDH1A1LMNAUSP2
SCHEMBL14418803 0.81 ALOX15 (0.41) MAPTABCC4ALOX15ALDH1A1LMNA
SCHEMBL14418804 0.81 ALOX15 (0.41) MAPTABCC4ALOX15ALDH1A1LMNA
SCHEMBL14425131 0.80 ALOX15 (0.40) MAPTALOX15ALDH1A1USP2GGPS1
SCHEMBL14425128 0.80 ALOX15 (0.40) MAPTALOX15ALDH1A1USP2GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4356894-A1 SUSTAINABLE PRODUCT WITH MALODORS Beiersdorf AG (DE) 2024-04-24 EP claimed
EP-4356894-A1 SUSTAINABLE PRODUCT WITH MALODORS Beiersdorf AG (DE) 2024-04-24 EP disclosed
US-20140323768-A1 3-METHYL-6-CYCLOHEXADECEN-1-ONE AND ITS USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2014-10-30 US disclosed
US-20140323768-A1 3-METHYL-6-CYCLOHEXADECEN-1-ONE AND ITS USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2014-10-30 US disclosed
US-20140323768-A1 3-METHYL-6-CYCLOHEXADECEN-1-ONE AND ITS USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2014-10-30 US disclosed
US-8859820-B1 3-methyl-6-cyclohexadecen-1-one and its use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2014-10-14 US disclosed
US-8859820-B1 3-methyl-6-cyclohexadecen-1-one and its use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2014-10-14 US disclosed
US-8859820-B1 3-methyl-6-cyclohexadecen-1-one and its use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2014-10-14 US disclosed
US-8450265-B2 3-methyl-6-cyclohexadecen-1-one and its use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2013-05-28 US disclosed
US-8450265-B2 3-methyl-6-cyclohexadecen-1-one and its use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2013-05-28 US disclosed
US-8450265-B2 3-methyl-6-cyclohexadecen-1-one and its use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2013-05-28 US disclosed
US-20130052151-A1 3-METHYL-6-CYCLOHEXADECEN-1-ONE AND ITS USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2013-02-28 US disclosed
US-20130052151-A1 3-METHYL-6-CYCLOHEXADECEN-1-ONE AND ITS USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2013-02-28 US disclosed
US-20130052151-A1 3-METHYL-6-CYCLOHEXADECEN-1-ONE AND ITS USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2013-02-28 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 (1 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-20130052151-A1 3-METHYL-6-CYCLOHEXADECEN-1-ONE AND ITS USE IN PERFUME COMPOSITIONS OR51E2, OR10J3, CYP51A1 MAPT 3751/4885ABCC4 1999/4885ALOX15 17/4885

“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.