SCHEMBL26568835

SCHEMBL26568835

CC(C)(C)c1ccc(-c2ccccc2N(c2cccc(-c3cccc4c3sc3ccccc34)c2)c2ccccc2-c2cccc3cccc(-c4ccccc4)c23)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
TNKS O95271 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
S1PR4 O95977 1/20 0.33
S1PR5 Q9H228 1/20 0.33
GPR84 Q9NQS5 1/20 0.32
PRKDC P78527 1/20 0.31
TNF P01375 1/20 0.31
NOD1 Q9Y239 1/20 0.31
PARP14 Q460N5 1/20 0.30
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
SCHEMBL26568671 0.94 ALOX5 (0.38) ALOX5TNKSTNKS2S1PR4S1PR5
SCHEMBL26568326 0.94 ALOX5 (0.38) ALOX5PARP14LIMK1
SCHEMBL26568069 0.94 ALOX5 (0.38) ALOX5TNKSTNKS2PARP14LIMK1
SCHEMBL26568759 0.94 ALOX5 (0.38) ALOX5TNKSTNKS2S1PR4S1PR5
SCHEMBL26569355 0.92 ALOX5 (0.46) ALOX5TNKSTNKS2PRKDCPARP14
SCHEMBL26568833 0.91 GPR84 (0.33) TNKSTNKS2S1PR4S1PR5GPR84
SCHEMBL26568667 0.91 ALOX5 (0.38) ALOX5TNKSTNKS2S1PR4S1PR5
SCHEMBL26588302 0.91 ALOX5 (0.45) ALOX5TNKSTNKS2PRKDCPARP14
SCHEMBL26568929 0.90 ALOX5 (0.38) ALOX5TNKSTNKS2S1PR4S1PR5
SCHEMBL26568673 0.90 TNKS (0.36) ALOX5TNKSTNKS2S1PR4S1PR5

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-2023182323-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-09-28 WO disclosed