SCHEMBL5266422

SCHEMBL5266422

CC(C)CCC(C)C(=O)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.40
CA1 P00915 3/20 0.37
GABRR1 P24046 2/20 0.36
CYP1A2 P05177 1/20 0.36
HSD17B10 Q99714 1/20 0.35
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
CHRNB2 P17787 4/20 0.34
CHRNA4 P43681 4/20 0.34
CHRNB4 P30926 3/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34
CHRNA3 P32297 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 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
SCHEMBL11612613 0.86 BLM (0.52) BLMCA1CA12CA2CA9
SCHEMBL11599800 0.86 BLM (0.52) BLMCA1CA12CA2CA9
SCHEMBL23055054 0.82 CA1 (0.43) BLMCA1GABRR1CYP1A2CHRNB2
SCHEMBL20333647 0.81 GABRP (0.43) GABRR1CYP1A2CHRNB2CHRNA4CHRNB4
SCHEMBL11598715 0.81 BLM (0.62) BLMCA1CHRNB2CHRNA4CHRNB4
SCHEMBL15314113 0.80 CHRM1 (0.39) CA1CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL15314112 0.80 CHRM1 (0.39) CA1CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL10305030 0.80 CHRNB2 (0.34) GABRR1CYP1A2CHRNB2CHRNA4CHRNB4
SCHEMBL10305061 0.80 CHRNB2 (0.34) GABRR1CYP1A2CHRNB2CHRNA4CHRNB4
SCHEMBL23055048 0.80 CA1 (0.41) BLMCA1CHRNB2CHRNA4CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3607933-B1 BODY COSMETIC KAO CORP (JP) 2021-10-06 EP claimed
EP-1693057-B1 Confectionery products containing caffeine PROCTER & GAMBLE (US) 2007-10-03 EP claimed
EP-1182191-B1 Method for making amides INT FLAVORS & FRAGRANCES INC (US) 2004-07-14 EP claimed
US-6437183-B1 REACTING NITRILE COMPOUNDS WITH SULFATE COMPOUNDS IN DIOL OR TRIOL SOLVENT INTERNATIONAL FLAVORS & FRAGRANCES INC. 2002-08-20 US claimed
US-20020028969-A1 Method for making amides INTERNATIONAL FLAVORS & FRAGRANCES INC. 2002-03-07 US claimed
EP-1182191-A1 Method for making amides INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2002-02-27 EP claimed
US-6303817-B1 MORE SPECIFICALLY A METHOD OF MAKING BUTANAMIDES IN A NEW PROCESS; REACTION OF NITRILE COMPOUNDS AND A SULFATE COMPOUND INTERNATIONAL FLAVORS & FRAGRANCES INC. 2001-10-16 US claimed
WO-2024232326-A1 COOLING TOOL 花王株式会社 2024-11-14 WO disclosed
WO-2024232328-A1 COOLING TOOL 花王株式会社 2024-11-14 WO disclosed
WO-2023149102-A1 COOLING TOOL 花王株式会社 2023-08-10 WO disclosed
WO-2022168435-A1 MASK 花王株式会社 2022-08-11 WO disclosed
WO-2020071186-A1 ADHESIVE SHEET FOR AFFIXATION TO BODY, HOUSED IN CONTAINER 花王株式会社 2020-04-09 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 (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-20020028969-A1 Method for making amides NAAA, NIT2, SULT2A1 BLM 3639/4885CA1 136/4885GABRR1 4630/4885

“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.