SCHEMBL11409784

SCHEMBL11409784

C#Cc1cc[c]c(SC)c1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.34

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
SCHEMBL1638073 0.80 ALDH1A1 (0.32) HDAC8
SCHEMBL455667 0.72
SCHEMBL40745 0.70 MCL1 (0.31)
SCHEMBL6689004 0.70
SCHEMBL2189095 0.70 HDAC8 (0.34) HDAC8
SCHEMBL1419567 0.68
SCHEMBL18860926 0.68
SCHEMBL3215300 0.68
SCHEMBL15654795 0.68
SCHEMBL456783 0.68 CYP1A1 (0.31) HDAC8

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-4221895-A POLYESTER, POLYSULFONATE, OR POLYSULFINATE THE DOW CHEMICAL COMPANY (US) 1980-09-09 US disclosed