SCHEMBL23281137

SCHEMBL23281137

c1ccc(N(c2ccccc2)c2ccc(-c3cc(N(c4ccccc4)c4ccc5c(c4)Oc4ccccc4O5)c4sc5ccccc5c4c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
LIMK1 P53667 1/20 0.31
ALOX5 P09917 1/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
ATM Q13315 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 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
SCHEMBL23281157 0.88 TNKS (0.33) TNKSTNKS2LIMK1
SCHEMBL23281100 0.88 TNKS (0.33) TNKSTNKS2LIMK1
SCHEMBL23281251 0.88 TNKS (0.31) TNKSTNKS2
SCHEMBL23281232 0.88 TNKS (0.32) TNKSTNKS2LIMK1ALOX5
SCHEMBL23281140 0.88 TNKS (0.32) TNKSTNKS2LIMK1
SCHEMBL23281244 0.87 TNKS (0.34) TNKSTNKS2LIMK1
SCHEMBL23281237 0.86 ALOX5 (0.32) TNKSTNKS2ALOX5
SCHEMBL29312246 0.86 TNKS (0.43) TNKSTNKS2LIMK1ALOX5L3MBTL1
SCHEMBL29312287 0.86 TNKS (0.43) TNKSTNKS2LIMK1ALOX5L3MBTL1
SCHEMBL29312252 0.86 TNKS (0.43) TNKSTNKS2LIMK1ALOX5L3MBTL1

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-2021080334-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-04-29 WO disclosed