SCHEMBL28290068

SCHEMBL28290068

CCCCCCCCCCCCCCCCCc1nc2cccc(Cc3ccccc3)c2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 7/20 0.48
PARP1 P09874 1/20 0.48
POLB P06746 1/20 0.43
GAA P10253 1/20 0.41

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
Hydrogen Sulfide SCHEMBL28290029 0.99 TLR8 (0.47) TLR8PARP1POLBGAA
SCHEMBL27696704 0.86 PARP1 (0.48) TLR8PARP1POLB
SCHEMBL28298728 0.86 PARP1 (0.48) TLR8PARP1POLB
SCHEMBL28988341 0.86 PARP1 (0.48) TLR8PARP1POLB
SCHEMBL16097303 0.86 PARP1 (0.48) TLR8PARP1POLB
SCHEMBL3857633 0.85 PARP1 (0.49) TLR8PARP1POLB
SCHEMBL28217562 0.82 GAA (0.60) GAA
SCHEMBL6757114 0.81 PARP1 (0.48) PARP1POLB
SCHEMBL6755305 0.81 PARP1 (0.48) PARP1POLB
SCHEMBL6759164 0.81 PARP1 (0.48) PARP1POLB

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
CN-104212434-B Method for reducing back pressure of single-pipe gathering and transportation wellhead of high-water-content oil field 中国石油天然气股份有限公司 2019-04-05 CN disclosed