SCHEMBL3634950

SCHEMBL3634950

C#CCOC1=C[CH]CCC1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 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
SCHEMBL8371354 0.66 POLB (0.31) POLBMAPK1HSD17B10
SCHEMBL3638445 0.65
SCHEMBL3637853 0.63 POLB (0.35) POLBMAPK1HSD17B10
SCHEMBL3204571 0.57 GSTP1 (0.52) POLBMAPK1HSD17B10
SCHEMBL5731101 0.56
SCHEMBL6826962 0.56 KCNH2 (0.33)
SCHEMBL3635801 0.56
Hydrochloric Acid SCHEMBL21694040 0.56 CA12 (0.61) POLBMAPK1HSD17B10
SCHEMBL7637940 0.54
SCHEMBL17404780 0.54 GSTP1 (0.44) POLBMAPK1HSD17B10

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-2162429-A2 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2010-03-17 EP disclosed
WO-2009005110-A2 HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-08 WO disclosed