SCHEMBL13558215

SCHEMBL13558215

CCCCCCCCCCCCn1c(=O)c2cc(Br)sc2c2sc(Br)cc21

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RORA P35398 7/20 0.41
▸ RORC P51449 7/20 0.41
▸ RORB Q92753 7/20 0.41
▸ PGR P06401 7/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.39
▸ MAPT P10636 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HTT P42858 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TNF P01375 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ FAAH O00519 1/20 0.35
▸ MGLL Q99685 1/20 0.35

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
SCHEMBL2418945 0.92 TDP1 (0.45) RORARORCRORBPGRNPC1
SCHEMBL16155984 0.92 TDP1 (0.45) RORARORCRORBPGRNPC1
SCHEMBL15277852 0.92 TDP1 (0.45) RORARORCRORBPGRNPC1
SCHEMBL15979462 0.92 TDP1 (0.45) RORARORCRORBPGRNPC1
SCHEMBL16155939 0.92 TDP1 (0.45) RORARORCRORBPGRNPC1
SCHEMBL15274951 0.85 PSEN1 (0.37) MAPTNPSR1FAAHMGLL
SCHEMBL12184971 0.85 PSEN1 (0.37) MAPTNPSR1FAAHMGLL
SCHEMBL15274946 0.85 PSEN1 (0.37) MAPTNPSR1FAAHMGLL
SCHEMBL4584716 0.85 PSEN1 (0.37) MAPTNPSR1FAAHMGLL
SCHEMBL21359651 0.84 RORA (0.31) RORARORCRORB

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-8394919-B2 Semiconductor materials based on dithienopyridone copolymers BASF SE (DE) 2013-03-12 — — US disclosed
US-20120277391-A1 SEMICONDUCTOR MATERIALS BASED ON DITHIENOPYRIDONE COPOLYMERS BASF SE (DE) 2012-11-01 — — US disclosed
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