SCHEMBL4593867

SCHEMBL4593867

CCCC(=O)CC1C(C)=CCCC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTPN1 P18031 1/20 0.32
CDC25A P30304 1/20 0.32
DUSP3 P51452 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL1229826 0.88 ALOX15 (0.51) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL8656171 0.81 ALOX15 (0.47) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL1844934 0.79 ALOX15 (0.49) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL9618004 0.79 ALOX15 (0.46) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL20610516 0.79 ALOX15 (0.49) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL1892089 0.78 ALDH1A1 (0.48) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL15265690 0.77 ALDH1A1 (0.35) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL6830360 0.77 ALOX15 (0.43) ALOX15ALDH1A1CYP3A4TDP1CDC25A
SCHEMBL6936899 0.76 ALOX15 (0.50) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL8516333 0.76 ALOX15 (0.49) ALOX15ALDH1A1CYP3A4TDP1CDC25A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1238649-B1 Hair dye compositions comprising acidic dyes and lactones KAO CORP (JP) 2008-01-09 EP disclosed
US-6776803-B2 Hair dye compositions KAO CORPORATION (JP) 2004-08-17 US disclosed
US-20030066141-A1 Hair dye compositions KAO CORPORATION (JP) 2003-04-10 US disclosed
EP-1238649-A2 Hair dye compositions Kao Corporation (JP) 2002-09-11 EP 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-20030066141-A1 Hair dye compositions HAAO, SRD5A1, GLA ALOX15 192/4885ALDH1A1 661/4885CYP3A4 516/4885

“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.