SCHEMBL4304542

SCHEMBL4304542

O=C1CCCCC/C=C/CCCCCCCC1.O=C1CCCCCC/C=C/CCCCCCC1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRIM24 O15164 2/20 0.65
▸ TRIM33 Q9UPN9 2/20 0.65
▸ ALDH1A1 P00352 2/20 0.65
▸ HDAC3 O15379 4/20 0.35
▸ HDAC4 P56524 4/20 0.35
▸ HDAC1 Q13547 4/20 0.35
▸ HDAC7 Q8WUI4 4/20 0.35
▸ HDAC2 Q92769 4/20 0.35
▸ HDAC10 Q969S8 4/20 0.35
▸ HDAC11 Q96DB2 4/20 0.35
▸ HDAC8 Q9BY41 4/20 0.35
▸ HDAC6 Q9UBN7 4/20 0.35
▸ HDAC9 Q9UKV0 4/20 0.35
▸ HDAC5 Q9UQL6 4/20 0.35
▸ CXCR3 P49682 1/20 0.32

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
SCHEMBL9355139 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL585911 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL6055738 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL2197196 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL2193814 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL2193820 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL2196655 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL4903660 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL15419872 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL3394636 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090162308-A1 USE OF 2,4'-DIMETHYLPROPIOPHENONE AS A FRAGRANCE SUBSTANCE SYMRISE GMBH & CO. KG (DE) 2009-06-25 — — 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-20090162308-A1 USE OF 2,4'-DIMETHYLPROPIOPHENONE AS A FRAGRANCE SUBSTANCE CYP1B1, CYP4A22, ROS1 TRIM24 3691/4885TRIM33 1600/4885ALDH1A1 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.

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