SCHEMBL19865079

SCHEMBL19865079

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
GABRR1 P24046 1/20 0.33
GRM2 Q14416 3/20 0.32
GRM3 Q14832 3/20 0.32
SLC1A2 P43004 3/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
GRM8 O00222 1/20 0.31
GRM6 O15303 1/20 0.31
LMNA P02545 1/20 0.31
APEX1 P27695 1/20 0.31
GRM5 P41594 1/20 0.31
PMP22 Q01453 1/20 0.31
GRM1 Q13255 1/20 0.31
GRM4 Q14833 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC1A1 P43005 2/20 0.31
TRPM8 Q7Z2W7 1/20 0.30

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
SCHEMBL19809897 1.00 EPHX1 (0.38) EPHX1GABRR1GRM2GRM3SLC1A2
SCHEMBL19809803 0.82 EPHX1 (0.53) EPHX1
SCHEMBL19809890 0.79 TRPM8 (0.36) EPHX1CYP2C19TRPM8
SCHEMBL24072311 0.78 GABRR1 (0.42) EPHX1GABRR1GRM2GRM3SLC1A2
SCHEMBL12808697 0.78 GABRR1 (0.42) EPHX1GABRR1GRM2GRM3SLC1A2
SCHEMBL19730178 0.78 GABRR1 (0.42) EPHX1GABRR1GRM2GRM3SLC1A2
SCHEMBL8286216 0.75 GABRR1 (0.48) GABRR1GRM2GRM3SLC1A2CYP2C9
SCHEMBL8175844 0.75 GABRR1 (0.48) GABRR1GRM2GRM3SLC1A2CYP2C9
SCHEMBL11250069 0.72 EPHX1 (0.33) EPHX1GABRR1GRM2GRM3MEN1
SCHEMBL11000712 0.72 PPP5C (0.39) GABRR1GRM2GRM3CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11696884-B2 Compositions comprising menthol compounds as smoothing agents SYMRISE AG (DE) 2023-07-11 US disclosed
US-20180042832-A1 COMPOSITIONS COMPRISING MENTHOL COMPOUNDS AS SMOOTHING AGENTS SYMRISE AG (DE) 2018-02-15 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 (2 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-11696884-B2 Compositions comprising menthol compounds as smoothing agents SMURF1, SMURF2, S1PR2 EPHX1 2359/4885GABRR1 61/4885GRM2 958/4885
US-20180042832-A1 COMPOSITIONS COMPRISING MENTHOL COMPOUNDS AS SMOOTHING AGENTS SMURF1, SMURF2, S1PR2 EPHX1 2359/4885GABRR1 61/4885GRM2 958/4885

“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.