SCHEMBL23281237

SCHEMBL23281237

Clc1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)Oc4ccccc4O5)cc3)cc3c2sc2ccccc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
PTPN1 P18031 1/20 0.30
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 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
SCHEMBL23281232 0.88 TNKS (0.32) ALOX5TNKSTNKS2
SCHEMBL23281137 0.86 TNKS (0.33) ALOX5TNKSTNKS2
SCHEMBL23281251 0.83 TNKS (0.31) TNKSTNKS2
SCHEMBL23281218 0.83 PTGDR2 (0.30)
SCHEMBL23281244 0.82 TNKS (0.34) TNKSTNKS2
SCHEMBL29312178 0.82 TNKS (0.42) ALOX5PTPN1TNKSTNKS2
SCHEMBL29312380 0.82 TNKS (0.42) ALOX5PTPN1TNKSTNKS2
SCHEMBL29312343 0.82 TNKS (0.42) ALOX5PTPN1TNKSTNKS2
SCHEMBL18998373 0.82 TNKS (0.42) ALOX5PTPN1TNKSTNKS2
SCHEMBL29312154 0.82 TNKS (0.42) ALOX5PTPN1TNKSTNKS2

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