SCHEMBL19986181

SCHEMBL19986181

c1ccc2c(c1)sc1c(-c3ccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7sc6c54)cc3)cccc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
PRKDC P78527 4/20 0.35
PARP14 Q460N5 1/20 0.34
TP53 P04637 1/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CB P42338 2/20 0.31
BRD4 O60885 1/20 0.31
PIK3CA P42336 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31
KCNH2 Q12809 1/20 0.31
BRDT Q58F21 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
SCHEMBL16867292 0.94 ALOX5 (0.45) ALOX5PRKDCPARP14TP53PIK3CD
SCHEMBL17246654 0.94 ALOX5 (0.45) ALOX5PRKDCPARP14TP53PIK3CD
SCHEMBL19985988 0.91 ALOX5 (0.34) ALOX5TP53BRDT
SCHEMBL16866931 0.91 ALOX5 (0.44) ALOX5PRKDCPARP14TP53PIK3CD
SCHEMBL19985913 0.90 CA12 (0.34) ALOX5PRKDCTP53
SCHEMBL19985943 0.89 KDM4E (0.37) ALOX5TP53
SCHEMBL19985925 0.89 KDM4E (0.37) ALOX5TP53
SCHEMBL19986006 0.89 ALOX5 (0.45) ALOX5PRKDCPARP14TP53PIK3CD
SCHEMBL19985965 0.89 ALOX5 (0.33) ALOX5TP53
SCHEMBL17228921 0.88 ALOX5 (0.46) ALOX5PRKDCPARP14TP53PIK3CD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed