SCHEMBL18748616

SCHEMBL18748616

c1ccc(-c2ccc3c(c2)c2c4ccccc4c4c5ccccc5sc4c2n3-c2ccc(-c3cccc4ccccc34)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA9 Q16790 3/20 0.37
F9 P00740 1/20 0.35
ALK Q9UM73 1/20 0.34
PDE6D O43924 1/20 0.33
ALOX5 P09917 1/20 0.33
PRKDC P78527 1/20 0.31
LIMK1 P53667 1/20 0.31
S1PR4 O95977 1/20 0.31
S1PR5 Q9H228 1/20 0.31
MCL1 Q07820 1/20 0.31
ACMSD Q8TDX5 1/20 0.31
SLC9A1 P19634 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
SCHEMBL18748704 1.00 CA12 (0.37) CA12CA1CA2CA9F9
SCHEMBL18748625 0.97 ALOX5 (0.36) CA12CA1CA2CA9F9
SCHEMBL18748647 0.95 ALOX5 (0.37) CA12CA1CA2CA9F9
SCHEMBL18748654 0.93 S1PR5 (0.36) CA12CA1CA2CA9F9
SCHEMBL15126832 0.93 ALOX5 (0.37) CA12CA1CA2CA9F9
SCHEMBL15126615 0.90 LIMK1 (0.36) ALOX5LIMK1
SCHEMBL18748645 0.90 LIMK1 (0.36) ALOX5LIMK1
SCHEMBL18748681 0.90 LIMK1 (0.36) ALOX5LIMK1
SCHEMBL18748694 0.90 LIMK1 (0.36) ALOX5LIMK1
SCHEMBL17427580 0.89 CA12 (0.35) CA12CA1CA2CA9F9

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-20170110669-A1 ORGANIC LIGHT EMITTING DEVICE AND DISPLAY DEVICE HAVING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-04-20 US disclosed
US-20170110669-A1 ORGANIC LIGHT EMITTING DEVICE AND DISPLAY DEVICE HAVING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-04-20 US disclosed