SCHEMBL23819657

SCHEMBL23819657

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5cc(-c6cccc7c6ccc6c8ccccc8sc76)ccc5c34)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 6/20 0.43
ALOX5 P09917 1/20 0.42
F9 P00740 1/20 0.34
MAPT P10636 2/20 0.34
SLC9A1 P19634 1/20 0.34
PIK3CD O00329 2/20 0.33
PIK3CB P42338 2/20 0.33
LIMK1 P53667 1/20 0.33
S1PR5 Q9H228 3/20 0.32
S1PR4 O95977 2/20 0.32
ESR2 Q92731 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
ATM Q13315 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 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
SCHEMBL23819653 0.96 PRKDC (0.42) PRKDCALOX5F9MAPTSLC9A1
SCHEMBL24216599 0.96 PRKDC (0.48) PRKDCALOX5F9MAPTSLC9A1
SCHEMBL24216339 0.95 PRKDC (0.47) PRKDCALOX5F9MAPTSLC9A1
SCHEMBL24216461 0.95 PRKDC (0.47) PRKDCALOX5F9MAPTSLC9A1
SCHEMBL24216464 0.95 PRKDC (0.47) PRKDCALOX5F9MAPTPIK3CD
SCHEMBL22329531 0.94 PRKDC (0.44) PRKDCALOX5F9MAPTSLC9A1
SCHEMBL23349784 0.94 PRKDC (0.46) PRKDCALOX5MAPTPIK3CDPIK3CB
SCHEMBL23820953 0.94 PRKDC (0.46) PRKDCALOX5MAPTPIK3CDPIK3CB
SCHEMBL25459237 0.93 PRKDC (0.46) PRKDCALOX5MAPTPIK3CDPIK3CB
SCHEMBL23819652 0.93 PRKDC (0.39) PRKDCALOX5F9MAPTSLC9A1

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-2021182833-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 WO disclosed