SCHEMBL21350183

SCHEMBL21350183

COC(=O)C1CC(C)CC[C@H]1C(C)C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.64
TRPM8 Q7Z2W7 5/20 0.56
TRPA1 O75762 2/20 0.48
TRPV1 Q8NER1 6/20 0.45
CYP3A4 P08684 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL13043160 1.00 EPHX1 (0.64) EPHX1TRPM8TRPA1TRPV1CYP3A4
SCHEMBL1439243 1.00 EPHX1 (0.64) EPHX1TRPM8TRPA1TRPV1CYP3A4
SCHEMBL14072926 0.87 EPHX1 (0.48) EPHX1TRPM8CYP3A4CYP1A2CYP2D6
SCHEMBL14072930 0.87 EPHX1 (0.48) EPHX1TRPM8CYP3A4CYP1A2CYP2D6
SCHEMBL14510042 0.85 EPHX1 (0.44) EPHX1TRPM8CYP3A4CYP1A2CYP2D6
SCHEMBL6923690 0.84 EPHX1 (0.62) EPHX1TRPM8TRPA1TRPV1
SCHEMBL1238085 0.84 EPHX1 (0.62) EPHX1TRPM8TRPA1TRPV1
SCHEMBL1439241 0.84 EPHX1 (0.62) EPHX1TRPM8TRPA1TRPV1
SCHEMBL10034576 0.83 EPHX1 (0.75) EPHX1TRPM8TRPA1TRPV1
SCHEMBL6128506 0.83 EPHX1 (0.75) EPHX1TRPM8TRPA1TRPV1

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-20190276389-A1 SYNTHESIS OF ARYL CYCLOHEXANE ESTER DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS THE PROCTER & GAMBLE COMPANY 2019-09-12 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-20190276389-A1 SYNTHESIS OF ARYL CYCLOHEXANE ESTER DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS CUTA, TAS2R8, TRPA1 EPHX1 1625/4885TRPM8 39/4885TRPA1 3/4885

“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.