SCHEMBL9561642

SCHEMBL9561642

COC(CC=CC=O)OC

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.42
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.31
RCE1 Q9Y256 1/20 0.30
GAPDH P04406 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
SCHEMBL9561638 1.00 TRPA1 (0.42) TRPA1MAPTHTTRCE1GAPDH
SCHEMBL11283630 0.76 TRPA1 (0.39) TRPA1
SCHEMBL11283632 0.76 TRPA1 (0.39) TRPA1
SCHEMBL31141201 0.75 HTT (0.31) MAPTHTTRCE1
SCHEMBL29621504 0.75 HTT (0.31) MAPTHTTRCE1
SCHEMBL11222507 0.75 TRPA1 (0.36) TRPA1MAPTHTTRCE1
SCHEMBL29621292 0.75 HTT (0.31) MAPTHTTRCE1
SCHEMBL1785166 0.75 TRPA1 (0.42) TRPA1GAPDH
SCHEMBL1782911 0.75 TRPA1 (0.37) TRPA1
SCHEMBL1782912 0.75 TRPA1 (0.37) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5220003-A Process for the synthesis of 2',3'-dideoxynucleosides THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1993-06-15 US claimed
US-5220003-A Process for the synthesis of 2',3'-dideoxynucleosides THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1993-06-15 US disclosed