SCHEMBL29316408

SCHEMBL29316408

Brc1ccc(-c2c3ccccc3c(-c3c(-c4ccccc4)oc4ccccc34)c3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.47
PLA2G4A P47712 1/20 0.47
TNKS O95271 1/20 0.44
PTGS2 P35354 3/20 0.44
PTGS1 P23219 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
MAPK1 P28482 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CYP3A4 P08684 2/20 0.43
ALOX15 P16050 2/20 0.43
DDR2 Q16832 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CA12 O43570 1/20 0.43
TP53 P04637 1/20 0.43
ABCB1 P08183 1/20 0.43
CALM1 P0DP23 1/20 0.43

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
SCHEMBL22954026 0.90 KMT2A (0.50) PLA2G2APLA2G4ATNKSPTGS2PTGS1
SCHEMBL29597506 0.90 KMT2A (0.50) PLA2G2APLA2G4ATNKSPTGS2PTGS1
SCHEMBL22954054 0.87 PTGS2 (0.54) PLA2G2APLA2G4APTGS2PTGS1SMN1; SMN2
SCHEMBL22954006 0.87 PTGS2 (0.54) PLA2G2APLA2G4APTGS2PTGS1SMN1; SMN2
SCHEMBL29598541 0.87 PTGS2 (0.54) PLA2G2APLA2G4APTGS2PTGS1SMN1; SMN2
SCHEMBL29597790 0.87 PTGS2 (0.54) PLA2G2APLA2G4APTGS2PTGS1SMN1; SMN2
SCHEMBL29316396 0.85 KMT2A (0.46) PLA2G2APLA2G4ATNKSPTGS2PTGS1
SCHEMBL29321405 0.84 TNKS (0.41) PLA2G2APLA2G4ATNKSPTGS2PTGS1
SCHEMBL24817315 0.82 ALDH1A1 (0.47) PLA2G2APLA2G4ATNKSPTGS2SMN1; SMN2
SCHEMBL592430 0.81 CA1 (0.55) PLA2G2APLA2G4ATNKSPTGS2PTGS1

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
US-20240237383-A1 ORGANIC ELECTROLUMINESCENT DEVICE SFC CO., LTD. (KR) 2024-07-11 US disclosed