SCHEMBL17640302

SCHEMBL17640302

CC1(C)c2ccccc2-c2ccc(-c3cccc4c3oc3c(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccccc8)cc7)n6)c5)cccc34)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
PDK2 Q15119 4/20 0.34
PRKDC P78527 9/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
HPGD P15428 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL17640305 0.99 PDK2 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17640467 0.99 PDK2 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17425720 0.99 PDK2 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17425709 0.99 ALOX5 (0.35) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17640296 0.99 ALOX5 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17640356 0.99 ALOX5 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17640309 0.98 PDK2 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17640298 0.98 ALOX5 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17640345 0.98 PDK2 (0.37) ALOX5PDK2PRKDCALDH1A1MAPT
SCHEMBL17425485 0.98 ALOX5 (0.36) ALOX5PDK2PRKDCALDH1A1MAPT

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-20170054087-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-02-23 US disclosed
US-20160093808-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-03-31 US disclosed