SCHEMBL17944404

SCHEMBL17944404

CC1(C)c2cc(-c3ccc4c(c3)c3ccccc3c3c5ccccc5sc43)ccc2-c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc21

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.32
ALOX5 P09917 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
HCRTR1 O43613 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
LIMK1 P53667 1/20 0.31
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
F9 P00740 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
SCHEMBL17944398 0.93 LIMK1 (0.34) LIMK1
SCHEMBL17944958 0.93 LIMK1 (0.34) ALOX5LIMK1
SCHEMBL17945429 0.92 ALOX5 (0.35) PTPN1ALOX5KDM4EMEN1HCRTR1
SCHEMBL19110339 0.91 PTPN1 (0.36) PTPN1ALOX5LIMK1TNKSTNKS2
SCHEMBL19110358 0.91 LIMK1 (0.34) PTPN1ALOX5LIMK1TNKSTNKS2
SCHEMBL19110341 0.89 LIMK1 (0.30) LIMK1
SCHEMBL19110365 0.89 LIMK1 (0.30) LIMK1
SCHEMBL17944402 0.89 ALOX5 (0.34) ALOX5
SCHEMBL19110362 0.88 ALOX5 (0.36) ALOX5LIMK1TNKSTNKS2F9
SCHEMBL19110353 0.87 ALOX5 (0.33) ALOX5LIMK1TNKSTNKS2

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-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed