SCHEMBL22435652

SCHEMBL22435652

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3-c3ccccc3)c3cccc4c3sc3ccccc34)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.45
F9 P00740 1/20 0.37
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PRKDC P78527 2/20 0.33
LIMK1 P53667 2/20 0.33
PARP14 Q460N5 1/20 0.33
SLC9A1 P19634 1/20 0.32
GPR3 P46089 1/20 0.30
PTPN1 P18031 1/20 0.30
PIM3 Q86V86 1/20 0.30

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
SCHEMBL22435656 0.95 ALOX5 (0.41) ALOX5F9TNKSTNKS2PRKDC
SCHEMBL22435653 0.95 ALOX5 (0.41) ALOX5F9TNKSTNKS2PRKDC
SCHEMBL22435665 0.95 ALOX5 (0.41) ALOX5F9TNKSTNKS2PRKDC
SCHEMBL22435654 0.94 ALOX5 (0.43) ALOX5F9TNKSTNKS2PRKDC
SCHEMBL22435661 0.94 ALOX5 (0.39) ALOX5F9TNKSTNKS2LIMK1
SCHEMBL22435664 0.94 ALOX5 (0.40) ALOX5F9TNKSTNKS2PRKDC
SCHEMBL22435666 0.93 ALOX5 (0.40) ALOX5F9TNKSTNKS2LIMK1
SCHEMBL22435705 0.92 ALOX5 (0.43) ALOX5F9TNKSTNKS2PRKDC
SCHEMBL24370276 0.92 ALOX5 (0.44) ALOX5F9TNKSTNKS2PRKDC
SCHEMBL22435784 0.92 ALOX5 (0.52) ALOX5F9TNKSTNKS2PRKDC

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020185054-A9 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed
WO-2020185054-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-09-17 WO disclosed