SCHEMBL19001936

SCHEMBL19001936

c1ccc(-c2ccc(N(c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccc(-c5ccccc5)cc43)c3cccc4oc5ccccc5c34)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.33
PLA2G2A P14555 2/20 0.31
PLA2G4A P47712 2/20 0.31

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
SCHEMBL20434395 1.00 PDK2 (0.33) PDK2PLA2G2APLA2G4A
SCHEMBL20434391 1.00 PDK2 (0.33) PDK2PLA2G2APLA2G4A
SCHEMBL21094683 0.97 PDK2 (0.33) PDK2PLA2G2APLA2G4A
SCHEMBL23222526 0.95 PDK2 (0.33) PDK2PLA2G2APLA2G4A
SCHEMBL25608225 0.95
SCHEMBL17816813 0.95
SCHEMBL20434369 0.95
SCHEMBL20434399 0.94 PDK2 (0.30) PDK2
SCHEMBL24725430 0.94 PLA2G2A (0.32) PLA2G2APLA2G4A
SCHEMBL19166885 0.94 PDK2 (0.36) PDK2PLA2G2APLA2G4A

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
EP-3390365-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-04-14 EP disclosed
WO-2017102063-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-06-22 WO disclosed