SCHEMBL15470488

SCHEMBL15470488

c1ccc(-c2ccc3c(c2)Oc2cc(-c4cccc5ccccc45)ccc2N3c2ccc(-c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
S1PR5 Q9H228 7/20 0.34
S1PR4 O95977 6/20 0.34
MCL1 Q07820 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
F9 P00740 1/20 0.33
ALOX5 P09917 1/20 0.33
PIM3 Q86V86 1/20 0.33
PRKDC P78527 2/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
LIMK1 P53667 1/20 0.32
ALK Q9UM73 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 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
SCHEMBL13827528 0.90 LIMK1 (0.37) PIM3PRKDCLIMK1ALDH1A1MAPT
SCHEMBL15470168 0.90 LIMK1 (0.37) PIM3PRKDCLIMK1ALDH1A1MAPT
SCHEMBL15470280 0.90 ALOX5 (0.44) PDE6DCA12CA1CA2CA9
SCHEMBL15470175 0.87 LIMK1 (0.35) PIM3LIMK1ALDH1A1MAPTHPGD
SCHEMBL13827262 0.87 LIMK1 (0.35) PIM3LIMK1ALDH1A1MAPTHPGD
SCHEMBL15470209 0.86 PDE6D (0.36) PDE6DCA12CA1CA2CA9
SCHEMBL15470176 0.86 PIM3 (0.38) F9ALOX5PIM3PRKDCLIMK1
SCHEMBL15470254 0.85 PDE6D (0.36) PDE6DCA12CA1CA2CA9
SCHEMBL15470174 0.84 LIMK1 (0.33) PIM3LIMK1ALDH1A1MAPTTDP1
SCHEMBL17206598 0.83 PDE6D (0.43) PDE6DCA12CA1CA2CA9

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-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed