SCHEMBL18035643

SCHEMBL18035643

CC=Cc1ccc(O)c(OC)c1CCC

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.39
ALOX5 P09917 6/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
PTPN1 P18031 2/20 0.34
TRPV1 Q8NER1 1/20 0.34
HMGCR P04035 2/20 0.34
CYP3A4 P08684 1/20 0.33
APP P05067 1/20 0.33
MAPT P10636 1/20 0.33
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33
DRD3 P35462 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
PPARG P37231 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
SCHEMBL18035640 0.91 ALOX5 (0.44) TYRALOX5CA1CA2GABRA1
SCHEMBL15914612 0.89 ALOX5 (0.50) TYRALOX5TRPV1
SCHEMBL874193 0.89 TYR (0.40) TYRALOX5CA1CA2GABRA1
SCHEMBL26046430 0.85 TYR (0.40) TYRALOX5CA1CA2GABRA1
SCHEMBL31152022 0.83 SMPD1 (0.41) TYRALOX5CA1CA2GABRA1
SCHEMBL25322106 0.79 TYR (0.46) TYRALOX5CA1CA2GABRA1
SCHEMBL873591 0.79 CA1 (0.40) TYRALOX5CA1CA2GABRA1
SCHEMBL26046434 0.78 TYR (0.44) TYRALOX5CA1CA2GABRA1
SCHEMBL28544350 0.78 TYR (0.44) TYRALOX5CA1CA2GABRA1
SCHEMBL358256 0.76 TYR (0.43) TYRALOX5CA1CA2GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3061448-B1 COMPOSITION CONTAINING EUGENOL AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING ATOPIC DERMATITIS SEOUL NAT UNIV R&DB FOUNDATION (KR) 2020-07-29 EP disclosed
US-20160256421-A1 COMPOSITION CONTAINING EUGENOL AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING ATOPIC DERMATITIS SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2016-09-08 US disclosed
EP-3061448-A1 COMPOSITION CONTAINING EUGENOL AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING ATOPIC DERMATITIS Seoul National University R&DB Foundation (KR) 2016-08-31 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-20160256421-A1 COMPOSITION CONTAINING EUGENOL AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING ATOPIC DERMATITIS EBP, TSLP, EED TYR 7/4885ALOX5 352/4885CA1 4602/4885

“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.