SCHEMBL6399188

SCHEMBL6399188

N#CCOCCCC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
MCL1 Q07820 1/20 0.41
SLC1A3 P43003 2/20 0.33
SLC1A2 P43004 2/20 0.33
SLC1A1 P43005 2/20 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
SCHEMBL6972217 0.83 TSHR (0.44) TSHR
SCHEMBL27819968 0.78 GAA (0.40) TSHR
SCHEMBL27863810 0.76 GAA (0.39) TSHR
SCHEMBL25773441 0.75 TSHR (0.41) TSHR
SCHEMBL30480105 0.75 TSHR (0.66) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL25769637 0.74 TSHR (0.40) TSHR
SCHEMBL6971061 0.73
SCHEMBL6971056 0.73
SCHEMBL27601993 0.72 MCL1 (0.39) TSHRMCL1SLC1A3SLC1A2SLC1A1
SCHEMBL21337781 0.72

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-6967196-B1 Sulfonamide compounds and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-22 US disclosed