SCHEMBL12487451

SCHEMBL12487451

Bc1cc(B)cc(-c2cccc3c2Oc2ccccc2S3)c1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.45
PRKDC P78527 1/20 0.41
ADK P55263 1/20 0.34

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
SCHEMBL12488705 0.90 ATM (0.44) ATMPRKDCADK
SCHEMBL8302432 0.82 ATM (0.50) ATMPRKDCADK
SCHEMBL12490334 0.78 ATM (0.44) ATMPRKDCADK
SCHEMBL16787343 0.77 ATM (0.46) ATMPRKDCADK
SCHEMBL12488562 0.76 ATM (0.41) ATMPRKDCADK
SCHEMBL12489912 0.75 PRKDC (0.43) ATMPRKDCADK
SCHEMBL15478547 0.75 ATM (0.43) ATMPRKDCADK
SCHEMBL19765367 0.75 ATM (0.50) ATMPRKDCADK
SCHEMBL12489648 0.74 PRKDC (0.43) ATMPRKDCADK
SCHEMBL12489907 0.74 PRKDC (0.41) ATMPRKDCADK

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-2011081451-A2 TRI-PHENYL COMPOUNDS AND ORGANIC ELECTRO-LUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2011-07-07 WO disclosed