SCHEMBL9523683

SCHEMBL9523683

O=C1/C=N\c2ccccc2/C=C\C=N/1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 5/20 0.36

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
SCHEMBL9523689 1.00 TRPA1 (0.36) TRPA1
SCHEMBL9523696 1.00 TRPA1 (0.36) TRPA1
SCHEMBL379612 0.74 TRPA1 (0.33) TRPA1
SCHEMBL379614 0.74 TRPA1 (0.33) TRPA1
Fluoride SCHEMBL28557472 0.72 TRPA1 (0.32) TRPA1
SCHEMBL27595489 0.70 TRPA1 (0.33) TRPA1
SCHEMBL4795499 0.69 TRPA1 (0.50) TRPA1
SCHEMBL4795502 0.69 TRPA1 (0.50) TRPA1
SCHEMBL3222725 0.68 TRPA1 (0.37) TRPA1
SCHEMBL30691872 0.67 TRPA1 (0.58) TRPA1

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
EP-0553107-A1 PROTEIN KINASE C MODULATORS WITH ANTI-INFLAMMATORY AND ANTIVIRAL ACTIVITY PROCYON PHARMACEUTICALS, INC. (US) 1993-08-04 EP disclosed