SCHEMBL19851744

SCHEMBL19851744

CNc1ccc(C)c(C(C)C)c1C(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
TRPA1 O75762 1/20 0.30
PTGS1 P23219 1/20 0.30
CACNA1C Q13936 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
SCHEMBL2267668 0.77
SCHEMBL3079555 0.69 LMNA (0.38) LMNATRPA1PTGS1CACNA1C
SCHEMBL10547149 0.67 LMNA (0.37) LMNATRPA1PTGS1CACNA1C
SCHEMBL25229039 0.67 TRPA1 (0.46) LMNATRPA1PTGS1CACNA1C
SCHEMBL1532606 0.67 CYP3A4 (0.37) LMNATRPA1PTGS1CACNA1C
SCHEMBL21023213 0.67 LMNA (0.48) LMNATRPA1PTGS1CACNA1C
SCHEMBL20987638 0.67 LMNA (0.54) LMNATRPA1PTGS1CACNA1C
SCHEMBL2270894 0.67 MAPT (0.37)
SCHEMBL18461006 0.65 IDO1 (0.33) LMNATRPA1PTGS1
SCHEMBL728304 0.65 L3MBTL1 (0.44) LMNA

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-10947214-B2 TLR7/8 antagonists and uses thereof MERCK PATENT GMBH (DE) 2021-03-16 US disclosed
US-20180037570-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2018-02-08 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-20180037570-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 LMNA 1770/4885TRPA1 346/4885PTGS1 1940/4885
US-10947214-B2 TLR7/8 antagonists and uses thereof TLR7, TLR8, TLR9 LMNA 1770/4885TRPA1 346/4885PTGS1 1940/4885

“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.