SCHEMBL4403474

SCHEMBL4403474

C=COC(C)(CC)CCCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL21596548 0.81 MEN1 (0.37) MEN1CYP3A4ALOX15KMT2A
SCHEMBL8008435 0.80 TSHR (0.33)
SCHEMBL17580416 0.79 MEN1 (0.43) MEN1CYP3A4ALOX15KMT2A
SCHEMBL10339783 0.79 MEN1 (0.39) MEN1CYP3A4ALOX15KMT2A
SCHEMBL4605879 0.78 MEN1 (0.40) MEN1CYP3A4ALOX15KMT2A
SCHEMBL9756530 0.75 MEN1 (0.37) MEN1CYP3A4ALOX15KMT2A
SCHEMBL7117349 0.74 MEN1 (0.34) MEN1CYP3A4ALOX15KMT2A
SCHEMBL11411026 0.74 MEN1 (0.36) MEN1CYP3A4ALOX15KMT2A
SCHEMBL18682927 0.72
SCHEMBL30098503 0.70 MEN1 (0.50) MEN1CYP3A4ALOX15KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1146033-B1 Fragrance precursors GIVAUDAN SA (CH) 2009-12-23 EP disclosed
CN-1228298-C Perfumery precursor GIVAUDAN SA (CH) 2005-11-23 CN disclosed
US-6492563-B2 PROVIDES NON-VOLATILE PRECURSORS FOR VOLATILE FRAGRANT ESTERS FOR USE IN DETERGENT, A FABRIC SOFTENER, A WINDOW CLEANER, A HARD SURFACE CLEANER, AN ALL PURPOSE CLEANER, A FURNITURE POLISH, A SHAMPOO, A CONDITIONER, AN HAIRSPRAY, A COSMETIC GIVAUDAN SA (CH) 2002-12-10 US disclosed
US-20020077508-A1 Fragrance precursors GIVAUDAN SA (CH) 2002-06-20 US disclosed
EP-1146033-A2 Fragrance precursors Givaudan SA (CH) 2001-10-17 EP disclosed
CN-1317475-A Perfumery precursor GIVAUDAN SA (CH) 2001-10-17 CN 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-20020077508-A1 Fragrance precursors ADH5, FAAH, CBR3 MEN1 2890/4885CYP3A4 415/4885ALOX15 639/4885

“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.