SCHEMBL17944648

SCHEMBL17944648

c1ccc2c(-c3c4ccccc4c(-c4ccc(-c5ccc6c(c5)sc5c6ccc6sc7ccccc7c65)c5ccccc45)c4ccccc34)cccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.45
MAPT P10636 3/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PRKDC P78527 1/20 0.35
MCL1 Q07820 3/20 0.34
ACMSD Q8TDX5 1/20 0.34
F9 P00740 1/20 0.34
PTPN1 P18031 1/20 0.34
LIMK1 P53667 2/20 0.34
CA12 O43570 4/20 0.33
CA1 P00915 4/20 0.33
CA2 P00918 4/20 0.33
CA9 Q16790 4/20 0.33
GPR3 P46089 1/20 0.33
PARP14 Q460N5 1/20 0.33
S1PR4 O95977 2/20 0.32
S1PR5 Q9H228 2/20 0.32

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
SCHEMBL17944233 1.00 ALOX5 (0.45) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL24343172 0.96 ALOX5 (0.42) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL17945665 0.94 ALOX5 (0.43) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL17944586 0.94 ALOX5 (0.43) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL17944650 0.94 ALOX5 (0.43) ALOX5MAPTPRKDCMCL1ACMSD
SCHEMBL17945087 0.94 ALOX5 (0.46) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL24343142 0.94 ALOX5 (0.45) ALOX5PRKDCMCL1ACMSDF9
SCHEMBL17944649 0.93 MCL1 (0.37) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL17932222 0.92 ALOX5 (0.41) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL19082360 0.92 ALOX5 (0.36) ALOX5PRKDCMCL1ACMSDLIMK1

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