SCHEMBL23729019

SCHEMBL23729019

c1ccc2c(c1)oc1c(-c3ccc4c(c3)c3cccc5c3n4c3cccc4c6ccccc6n5c43)cccc12

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.54
PRKDC P78527 7/20 0.43
GGPS1 O95749 1/20 0.41
PTGES2 Q9H7Z7 1/20 0.41
ATM Q13315 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
PIK3CD O00329 1/20 0.35
PIK3CB P42338 1/20 0.35
PLA2G2A P14555 2/20 0.33
PLA2G4A P47712 2/20 0.33
PLA2G10 O15496 1/20 0.33
AHR P35869 1/20 0.33
HDAC8 Q9BY41 1/20 0.31
TSPO P30536 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31

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
SCHEMBL21710644 0.96 ALOX5 (0.56) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL19541037 0.95 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL21454046 0.95 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL21453757 0.91 ALOX5 (0.51) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL19541146 0.90 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL16621670 0.88 ALOX5 (0.50) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL22178727 0.87 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL20465319 0.87 ALOX5 (0.45) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL21473027 0.87 ALOX5 (0.49) ALOX5PRKDCGGPS1PTGES2ATM
SCHEMBL24601413 0.87 ALOX5 (0.57) ALOX5PRKDCGGPS1PTGES2ATM

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-2021153931-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-08-05 WO disclosed