SCHEMBL555559

SCHEMBL555559

CC(C)C1CCC(C)(OCC(=O)O)CC1O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.34
TRPM8 Q7Z2W7 2/20 0.34
SLC1A2 P43004 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 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
SCHEMBL21300577 0.81 TRPA1 (0.38) TRPA1TRPM8
SCHEMBL27336425 0.80 TRPA1 (0.33) TRPA1TRPM8
SCHEMBL28227226 0.79 LMNA (0.34)
SCHEMBL27480549 0.79 LMNA (0.34)
SCHEMBL27454663 0.77 TRPA1 (0.33) TRPA1TRPM8ALOX15
SCHEMBL28208660 0.77 TRPA1 (0.33) TRPA1TRPM8ALOX15
SCHEMBL27801263 0.77 TRPA1 (0.31) TRPA1TRPM8
SCHEMBL28148440 0.77 GPBAR1 (0.32) TRPA1TRPM8
SCHEMBL27480908 0.77 TRPA1 (0.34) TRPA1TRPM8
SCHEMBL27858906 0.77 TRPA1 (0.34) TRPA1TRPM8

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-20120035224-A1 Betulin derived compounds as anti-feedants for plant pests VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) 2012-02-09 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-20120035224-A1 Betulin derived compounds as anti-feedants for plant pests BET1, BTF3, BROX TRPA1 3264/4885TRPM8 3476/4885SLC1A2 3358/4885

“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.