SCHEMBL31070053

SCHEMBL31070053

CCCCCCc1ccc2c(c1)c1cc(CCCCCC)ccc1n2-c1ccc(/C=C/c2ccc(C=O)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORA P35398 1/20 0.46
RORC P51449 1/20 0.46
RORB Q92753 1/20 0.46
PLA2G4A P47712 1/20 0.41
FAAH O00519 1/20 0.40
MGLL Q99685 1/20 0.40
OXER1 Q8TDS5 1/20 0.36
KAT8 Q9H7Z6 2/20 0.36
PPARA Q07869 1/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36

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
SCHEMBL21591020 1.00 RORA (0.46) RORARORCRORBPLA2G4AFAAH
SCHEMBL21594496 1.00 RORA (0.46) RORARORCRORBPLA2G4AFAAH
SCHEMBL21591023 0.96 RORA (0.48) RORARORCRORBPLA2G4AFAAH
SCHEMBL21594316 0.90 RORA (0.44) RORARORCRORBFAAHMGLL
SCHEMBL21594506 0.90 RORA (0.44) RORARORCRORBFAAHMGLL
SCHEMBL21594433 0.90 RORA (0.44) RORARORCRORBFAAHMGLL
SCHEMBL23822841 0.89 RORA (0.44) RORARORCRORBFAAHMGLL
SCHEMBL21594436 0.89 RORA (0.44) RORARORCRORBFAAHMGLL
SCHEMBL21594498 0.86 RORA (0.41) RORARORCRORBFAAHMGLL
SCHEMBL23822846 0.85 TSHR (0.50) RORARORCRORBPLA2G4AFAAH

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112272662-B Optical data communication system comprising p-phenylenevinylene and specific p-phenylenevinylene 巴斯夫欧洲公司 2024-07-16 CN disclosed