SCHEMBL24890965

SCHEMBL24890965

Nc1ncc(C2CCCCC2)nc1C1CCCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.39
HRH4 Q9H3N8 3/20 0.39
TDO2 P48775 2/20 0.37
MAPK1 P28482 3/20 0.37
HRH2 P25021 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
FEN1 P39748 2/20 0.35
MAPKAPK2 P49137 1/20 0.35
ABL1 P00519 1/20 0.34
ALOX5AP P20292 1/20 0.34
TBK1 Q9UHD2 1/20 0.34
KMO O15229 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
SCHEMBL24890808 1.00 ATR (0.48) ATRL3MBTL1HRH4TDO2MAPK1
SCHEMBL3101453 0.82 L3MBTL1 (0.42) ATRL3MBTL1HRH4TDO2MAPK1
SCHEMBL9350414 0.82 L3MBTL1 (0.42) ATRL3MBTL1HRH4TDO2MAPK1
SCHEMBL13353984 0.81 TDO2 (0.37) ATRL3MBTL1HRH4TDO2HRH2
SCHEMBL24890645 0.81 TDO2 (0.37) ATRL3MBTL1HRH4TDO2HRH2
SCHEMBL17187742 0.80 ATR (0.47) ATRL3MBTL1HRH4TDO2MAPK1
SCHEMBL24248254 0.77 ATR (0.36) ATRFEN1ALOX5AP
SCHEMBL24890646 0.76 TDO2 (0.33) ATRTDO2HRH2HRH3FEN1
SCHEMBL15205265 0.74 MAPKAPK2 (0.41) ATRHRH4MAPK1MAPKAPK2
SCHEMBL28563124 0.72 TDO2 (0.37) TDO2HRH2HRH3

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
WO-2023284249-A1 IMIDAZOPYRAZINONE FLUORESCEIN AND PREPARATION METHOD THEREFOR 中国科学院深圳先进技术研究院 2023-01-19 WO disclosed