SCHEMBL24748990

SCHEMBL24748990

c1ccc(-c2ccc(-c3ccc4ccccc4c3)cc2N(c2ccc(-c3cccc4c3sc3ccccc34)cc2)c2cccc3c2sc2ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
S1PR5 Q9H228 13/20 0.35
S1PR4 O95977 10/20 0.35
F9 P00740 1/20 0.33
PRKDC P78527 1/20 0.32
PARP14 Q460N5 1/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
LIMK1 P53667 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
SCHEMBL24748366 0.97 ALOX5 (0.44) ALOX5S1PR5S1PR4F9PRKDC
SCHEMBL24748973 0.96 ALOX5 (0.37) ALOX5S1PR5S1PR4F9HSD17B1
SCHEMBL24749913 0.96 ALOX5 (0.37) ALOX5S1PR5S1PR4F9HSD17B1
SCHEMBL24748365 0.95 F9 (0.37) ALOX5S1PR5S1PR4F9HSD17B1
SCHEMBL24748360 0.95 ALOX5 (0.36) ALOX5S1PR5S1PR4F9HSD17B1
SCHEMBL24747932 0.94 ALOX5 (0.44) ALOX5S1PR5S1PR4F9PRKDC
SCHEMBL24749885 0.94 ALOX5 (0.44) ALOX5S1PR5S1PR4F9PRKDC
SCHEMBL24748367 0.94 ALOX5 (0.44) ALOX5S1PR5S1PR4F9PRKDC
SCHEMBL24749865 0.94 ALOX5 (0.44) ALOX5S1PR5S1PR4F9PRKDC
SCHEMBL24749881 0.94 ALOX5 (0.44) ALOX5S1PR5S1PR4F9PRKDC

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-2022259886-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE 出光興産株式会社 2022-12-15 WO disclosed