SCHEMBL10171043

SCHEMBL10171043

CCCCCOc1ccc(-c2csc(NC(=O)Cn3ncc4c3c(=O)n(C)c(=O)n4C)n2)cc1Cl

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 16/20 0.67
MAPT P10636 3/20 0.51
TRPV4 Q9HBA0 2/20 0.48
TRPV3 Q8NET8 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL10171371 0.90 TRPA1 (0.79) TRPA1MAPTSMN1; SMN2LMNA
SCHEMBL609734 0.90 TRPA1 (0.83) TRPA1MAPTTRPV4TRPV3SMN1; SMN2
SCHEMBL10171817 0.87 TRPA1 (0.72) TRPA1MAPT
SCHEMBL2696517 0.87 TRPA1 (0.73) TRPA1MAPTTRPV4SMN1; SMN2
SCHEMBL10171777 0.84 TRPA1 (0.65) TRPA1MAPT
SCHEMBL15746154 0.84 TRPA1 (0.84) TRPA1MAPTSMN1; SMN2LMNA
SCHEMBL15746155 0.83 TRPA1 (0.62) TRPA1MAPTTRPV4
SCHEMBL612868 0.82 TRPA1 (0.69) TRPA1MAPTTRPV4SMN1; SMN2
SCHEMBL2696346 0.81 MAPT (0.69) TRPA1MAPTTRPV4SMN1; SMN2
SCHEMBL612857 0.81 TRPA1 (0.73) TRPA1MAPTTRPV4

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-20120041004-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPAI MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2012-02-16 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-20120041004-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPAI MODULATORS TRPA1, TRPV1, TRPC3 TRPA1 1/4885MAPT 2007/4885TRPV4 12/4885

“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.