SCHEMBL19098399

SCHEMBL19098399

CC(C)C(CO)NCC1CCN(S)C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TRPV3 Q8NET8 8/20 0.33

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
SCHEMBL19098393 0.84 TRPV3 (0.34) TRPV3
SCHEMBL19083166 0.81 TRPV3 (0.33) TRPV3
SCHEMBL19122465 0.80 CHRM3 (0.34) TRPV3
SCHEMBL23025166 0.74 TRPV3 (0.38) TRPV3
SCHEMBL23275869 0.74 TRPV3 (0.38) TRPV3
SCHEMBL19064104 0.68 SLC6A1 (0.37) TRPV3
SCHEMBL19063732 0.68 SLC6A1 (0.37) TRPV3
SCHEMBL19063889 0.68 SLC6A1 (0.37) TRPV3
SCHEMBL19122994 0.68 SLC6A1 (0.37) TRPV3
SCHEMBL19063730 0.68 SLC6A1 (0.37) TRPV3

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-20170190713-A1 FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF WUXI APPTEC (HONG KONG) CO., LIMITED (HK) 2017-07-06 — — 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-20170190713-A1 FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF MKNK2, CYP2J2, PTGS2 TRPV3 2843/4885

“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.

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