SCHEMBL21941889

SCHEMBL21941889

c1ccc2nc(-n3c4ccccc4c4cc5c(cc43)sc3ccccc35)c(-c3cccc4c3oc3ccccc34)nc2c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.33
PRKDC P78527 2/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32

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
SCHEMBL19234968 0.94 ALOX5 (0.33) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL24849042 0.86
SCHEMBL21213479 0.85 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL21942024 0.85 TUBB4A (0.33)
SCHEMBL19655281 0.83 ATM (0.38) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL21716207 0.83 GSR (0.36) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL18962018 0.82 ALOX5 (0.33) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL24848976 0.82 CHEK2 (0.32)
SCHEMBL24848892 0.82 CYP1A2 (0.32)
SCHEMBL21717081 0.81 GSR (0.39) ALOX5PRKDCPIK3CDPIK3CB

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-2020085793-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2020-04-30 WO disclosed