SCHEMBL19257509

SCHEMBL19257509

Brc1ccc2c(c1)C1(C3=C2CCC=C3)c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.40
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTPRC P08575 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
PARP1 P09874 1/20 0.31
KDM1A O60341 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
SCHEMBL16371515 1.00 PDK2 (0.40) PDK2TDP1L3MBTL1PTPRCSLC6A2
SCHEMBL21336365 0.87 PDK2 (0.34) PDK2
SCHEMBL16372107 0.87 KMT2A (0.35)
SCHEMBL13523462 0.84 PDK2 (0.41) PDK2KDM1A
SCHEMBL20734798 0.84 SMN1; SMN2 (0.41) PDK2TDP1PTPRC
SCHEMBL13662375 0.84
SCHEMBL13523422 0.84
SCHEMBL20941269 0.83 AHR (0.41)
SCHEMBL808148 0.82 PDK2 (0.39) PDK2
SCHEMBL12187061 0.80 PDK2 (0.41) PDK2

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
WO-2017135717-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2017-08-10 WO disclosed