SCHEMBL25907749

SCHEMBL25907749

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

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.54
TRPM8 Q7Z2W7 2/20 0.54
EPHX1 P07099 1/20 0.36
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 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
SCHEMBL25907747 1.00 TRPA1 (0.54) TRPA1TRPM8EPHX1CA1CA2
SCHEMBL25907743 1.00 TRPA1 (0.54) TRPA1TRPM8EPHX1CA1CA2
SCHEMBL25908020 1.00 TRPA1 (0.54) TRPA1TRPM8EPHX1CA1CA2
SCHEMBL12166520 0.92 TRPA1 (0.52) TRPA1TRPM8EPHX1
SCHEMBL16743130 0.87 TRPA1 (0.46) TRPA1TRPM8EPHX1CA1CA2
SCHEMBL853466 0.87 TRPA1 (0.46) TRPA1TRPM8EPHX1CA1CA2
SCHEMBL18611340 0.81 TRPA1 (0.47) TRPA1TRPM8EPHX1
SCHEMBL13909489 0.81 TRPA1 (0.47) TRPA1TRPM8EPHX1
SCHEMBL20824753 0.81 TRPA1 (0.47) TRPA1TRPM8EPHX1
SCHEMBL13712036 0.80

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-20230242526-A1 Deuterated Pyridopyrimidinones And Their Use As Highly Selective Cyclin-Dependent Kinase 2 Inhibitors ZENTAUR THERAPEUTICS INTERNATIONAL LIMITED (CN) 2023-08-03 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-20230242526-A1 Deuterated Pyridopyrimidinones And Their Use As Highly Selective Cyclin-Dependent Kinase 2 Inhibitors CDK2, CDK4, CCNI TRPA1 4820/4885TRPM8 4669/4885EPHX1 2530/4885

“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.