SCHEMBL26569199

SCHEMBL26569199

C1=c2cccc(-c3ccccc3)c2=C(c2ccccc2N(c2ccc(-c3ccccc3)cc2-c2ccccc2)c2ccccc2-c2cccc3c2sc2ccccc23)CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
PRKDC P78527 3/20 0.32
PIK3CD O00329 1/20 0.32
BRD4 O60885 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CG P48736 1/20 0.32
KCNH2 Q12809 1/20 0.32
BRDT Q58F21 1/20 0.32
PARP14 Q460N5 1/20 0.31

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
SCHEMBL26571675 0.89 ALOX5 (0.32) ALOX5
SCHEMBL26568834 0.86 ALOX5 (0.33) ALOX5PARP14
SCHEMBL26569460 0.84 ALOX5 (0.39) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL26573459 0.82 ALOX5 (0.30) ALOX5
SCHEMBL26568943 0.80 ALOX5 (0.30) ALOX5
SCHEMBL22161044 0.76 ALOX5 (0.45) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL22435781 0.75 ALOX5 (0.50) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL25628928 0.75 ALOX5 (0.43) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL25000617 0.75 ALOX5 (0.44) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL22155354 0.75 ALOX5 (0.44) ALOX5PRKDCPIK3CDBRD4PIK3CA

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