SCHEMBL17640481

SCHEMBL17640481

c1ccc2c(c1)sc1c(-c3ccc4sc5c(-n6c7ccccc7c7ccccc76)nccc5c4c3)cccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.49
PRKDC P78527 6/20 0.38
PARP14 Q460N5 1/20 0.34
TDO2 P48775 1/20 0.33
PIK3CD O00329 2/20 0.32
PIK3CB P42338 2/20 0.32
PIK3CA P42336 2/20 0.32
BRD4 O60885 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
LIMK1 P53667 2/20 0.32
DNPH1 O43598 1/20 0.31
HTT P42858 1/20 0.31
PAX8 Q06710 1/20 0.31
HTR2C P28335 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
PTGIR P43119 1/20 0.31
MAPT P10636 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
SCHEMBL25400853 0.89 ALOX5 (0.42) ALOX5PRKDCTDO2LIMK1DNPH1
SCHEMBL20751996 0.89 ALOX5 (0.40) ALOX5PRKDCLIMK1DNPH1
SCHEMBL11885006 0.87 ALOX5 (0.36) ALOX5PIK3CALIMK1HTR2CHRH4
SCHEMBL13245693 0.86 LIMK1 (0.36) ALOX5PIK3CALIMK1HTR2CHRH4
SCHEMBL11885004 0.85 ALOX5 (0.38) ALOX5PRKDCLIMK1HTR2CHRH4
SCHEMBL21316763 0.85 GPR3 (0.39) ALOX5PARP14PIK3CALIMK1HTR2C
SCHEMBL13245690 0.85 LIMK1 (0.37) ALOX5LIMK1
SCHEMBL18729487 0.85 ALOX5 (0.37) ALOX5PRKDC
SCHEMBL17640478 0.84 ALOX5 (0.43) ALOX5PRKDCPARP14TDO2PIK3CD
SCHEMBL22100002 0.83 PARP14 (0.39) ALOX5PRKDCPARP14PIK3CDPIK3CB

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