SCHEMBL8826015

SCHEMBL8826015

COc1nc(Br)cn2nc(S(=O)(=O)Nc3c(C)ccnc3F)nc12

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 10/20 0.34
EDNRA P25101 3/20 0.32
CCR5 P51681 1/20 0.32

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
SCHEMBL8129989 0.83 PKM (0.35)
SCHEMBL7851895 0.77 EIF2AK3 (0.34)
SCHEMBL7849753 0.74 HTT (0.36)
SCHEMBL7855692 0.73 TSHR (0.32) CCR4
SCHEMBL8881128 0.73 SCN9A (0.33)
SCHEMBL8825660 0.72 CCR4 (0.32) CCR4CCR5
SCHEMBL8825630 0.70 CCR4 (0.44) CCR4
SCHEMBL7851018 0.69 TSHR (0.35)
SCHEMBL7850611 0.68 FFAR4 (0.34)
SCHEMBL8825636 0.67 CCR4 (0.42) CCR4

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-5602075-A N-aryl[1,2,4]triazolo[1,5-a]pyrazine-2-sulfonamide herbicides DOWELANCO (US) 1997-02-11 US disclosed