SCHEMBL8735931

SCHEMBL8735931

CCCCCCCCCCCCCCCCc1ncccc1CCCN

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 9/20 0.47
HRH1 P35367 5/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LIPG Q9Y5X9 1/20 0.42
HTR2A P28223 1/20 0.42
CYP2A6 P11509 1/20 0.40

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
SCHEMBL1425613 0.92 TDP1 (0.49) TDP1L3MBTL1LIPG
SCHEMBL28163513 0.92 TDP1 (0.49) TDP1L3MBTL1LIPG
SCHEMBL28164157 0.92 TDP1 (0.49) TDP1L3MBTL1LIPG
SCHEMBL28135204 0.92 TDP1 (0.49) TDP1L3MBTL1LIPG
SCHEMBL27463695 0.92 TDP1 (0.49) TDP1L3MBTL1LIPG
SCHEMBL23768448 0.92 TDP1 (0.49) TDP1L3MBTL1LIPG
Bromide SCHEMBL28540729 0.90 TDP1 (0.47) TDP1L3MBTL1LIPG
SCHEMBL28182684 0.90 TDP1 (0.47) TDP1L3MBTL1LIPG
SCHEMBL461554 0.90 TDP1 (0.50) TLR8TDP1L3MBTL1LIPG
Hydrogen Sulfide SCHEMBL28566437 0.89 TDP1 (0.49) TLR8TDP1L3MBTL1LIPG

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
EP-0854895-A1 LIQUID AMINE COMPOUND AND BITUMINOUS EMULSIFIER PRODUCED USING SAME Kao Corporation (JP) 1998-07-29 EP disclosed
WO-1997013808-A1 LIQUID AMINE COMPOUND AND BITUMINOUS EMULSIFIER PRODUCED USING SAME KAO CORPORATION (JP) 1997-04-17 WO disclosed