SCHEMBL4167467

SCHEMBL4167467

CC1CCC(C(C)C)C(C(CCCCCCCCO)OC(=O)OC(CCCCCCCCO)C2CC(C)CCC2C(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.39
TRPM8 Q7Z2W7 3/20 0.37
TRPA1 O75762 2/20 0.37
CYP19A1 P11511 2/20 0.36
ALDH1A1 P00352 4/20 0.35
HPGD P15428 1/20 0.34
P2RX4 Q99571 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 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
SCHEMBL4167469 0.91 EPHX1 (0.38) EPHX1TRPM8TRPA1CYP19A1ALDH1A1
SCHEMBL29029157 0.89 EPHX1 (0.43) EPHX1TRPM8TRPA1CYP19A1ALDH1A1
SCHEMBL9474169 0.74 EPHX1 (0.50) EPHX1TRPM8TRPA1CYP19A1ALDH1A1
SCHEMBL9508470 0.72 TRPM8 (0.41) EPHX1TRPM8TRPA1CYP19A1ALDH1A1
SCHEMBL10859209 0.71 OPRM1 (0.39) EPHX1TRPM8TRPA1ALDH1A1MEN1
SCHEMBL537561 0.71 EPHX1 (0.48) EPHX1TRPM8CYP19A1ALDH1A1HPGD
SCHEMBL536647 0.71 EPHX1 (0.48) EPHX1TRPM8CYP19A1ALDH1A1HPGD
SCHEMBL29157263 0.70 CYP19A1 (0.54) EPHX1CYP19A1ALDH1A1HPGDMEN1
SCHEMBL29007136 0.70 TRPM8 (0.43) EPHX1TRPM8TRPA1CYP19A1ALDH1A1
SCHEMBL28431018 0.70 TRPM8 (0.46) EPHX1TRPM8TRPA1CYP19A1ALDH1A1

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
US-20090203776-A1 METHODS OF USING MENTHOL PROPYLENEGLYCOL-CARBONATE AND ANALOGS THEREOF FOR PRODUCING ANTI-INFLAMMATORY AND ANTI-ANGIOGENIC EFFECTS MATIAS JONATHAN R 2009-08-13 US claimed
WO-2006034495-A2 METHODS OF USING MENTHOL PROPYLENEGLYCOL-CARBONATE AND ANALOGS THEREOF FOR PRODUCING ANTI-INFLAMMATORY AND ANTI-ANGIOGENIC EFFECTS MATIAS JONATHAN R (US) 2006-03-30 WO claimed
US-20090203776-A1 METHODS OF USING MENTHOL PROPYLENEGLYCOL-CARBONATE AND ANALOGS THEREOF FOR PRODUCING ANTI-INFLAMMATORY AND ANTI-ANGIOGENIC EFFECTS MATIAS JONATHAN R 2009-08-13 US disclosed
WO-2006034495-A2 METHODS OF USING MENTHOL PROPYLENEGLYCOL-CARBONATE AND ANALOGS THEREOF FOR PRODUCING ANTI-INFLAMMATORY AND ANTI-ANGIOGENIC EFFECTS MATIAS JONATHAN R (US) 2006-03-30 WO 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-20090203776-A1 METHODS OF USING MENTHOL PROPYLENEGLYCOL-CARBONATE AND ANALOGS THEREOF FOR PRODUCING ANTI-INFLAMMATORY AND ANTI-ANGIOGENIC EFFECTS PTGIS, CAPG, PTGES EPHX1 1032/4885TRPM8 222/4885TRPA1 1063/4885

“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.