SCHEMBL22195580

SCHEMBL22195580

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5c4sc4cc(-c6nc(-c7ccccc7)c7sc8ccccc8c7n6)ccc45)n3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.41
▸ LIMK1 P53667 13/20 0.39
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ PRKDC P78527 1/20 0.35
▸ LIMK2 P53671 2/20 0.33
▸ TNKS O95271 2/20 0.33
▸ TNKS2 Q9H2K2 2/20 0.33
▸ PARP14 Q460N5 1/20 0.32
▸ WHR1 P49842 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
SCHEMBL22329481 1.00 ALOX5 (0.41) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22329455 1.00 ALOX5 (0.41) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22195819 0.99 ALOX5 (0.42) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22195824 0.99 ALOX5 (0.42) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22195667 0.99 ALOX5 (0.42) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22195668 0.99 ALOX5 (0.42) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22196142 0.98 LIMK1 (0.40) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22196136 0.98 LIMK1 (0.40) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22195840 0.98 LIMK1 (0.41) ALOX5LIMK1MEN1KMT2AATM
SCHEMBL22195705 0.98 ALOX5 (0.41) ALOX5LIMK1MEN1KMT2AATM

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-2020141949-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-07-09 — — WO disclosed
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