SCHEMBL9475161

SCHEMBL9475161

Sc1ccc(C2=NCCO2)cc1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
LTA4H P09960 1/20 0.43
LSS P48449 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
KCNN4 O15554 1/20 0.33
USP9X Q93008 1/20 0.33

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
SCHEMBL132013 0.91 KCNH2 (0.49) KCNH2HRH3LTA4HLSSSMN1; SMN2
SCHEMBL20410837 0.83 KCNH2 (0.44) KCNH2HRH3LTA4HLSSSMN1; SMN2
SCHEMBL10520360 0.83 KCNH2 (0.48) KCNH2HRH3LTA4HLSSSMN1; SMN2
SCHEMBL961792 0.81 KCNN4 (0.44) KCNH2HRH3LTA4HSMN1; SMN2KCNN4
SCHEMBL1817200 0.81 LSS (0.51) KCNH2HRH3LTA4HLSS
SCHEMBL1856955 0.81 NPC1 (0.43) KCNH2HRH3LTA4HLSSSMN1; SMN2
SCHEMBL20410952 0.81 KCNH2 (0.43) KCNH2HRH3LTA4HLSSSMN1; SMN2
SCHEMBL5464687 0.81 NPC1 (0.43) KCNH2HRH3LTA4HLSSSMN1; SMN2
SCHEMBL1814199 0.81 KCNH2 (0.43) KCNH2HRH3LTA4HLSSSMN1; SMN2
SCHEMBL9181791 0.81 KCNH2 (0.43) KCNH2HRH3LTA4HLSSSMN1; SMN2

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-5254664-A Containing a 2-oxazoline group; molding materials NIPPON SHOKUBAI CO., LTD. (JP) 1993-10-19 US disclosed