SCHEMBL5847445

SCHEMBL5847445

Brc1ccc2c(c1Br)C1(c3cc(I)ccc3-c3ccc(I)cc31)c1ccccc1-2

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 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
SCHEMBL5846604 0.87 KDM4E (0.38) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL29573891 0.87 KDM4E (0.38) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL19164650 0.85 S100A4 (0.37) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL1808660 0.80 KDM4E (0.41) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL22336460 0.80 KDM4E (0.41) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL13523410 0.80 KDM4E (0.41) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL6830565 0.78 MEN1 (0.42) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL808025 0.78 PDK2 (0.49) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL15138225 0.78 PDK2 (0.49) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL19091592 0.74 PDK2 (0.49) PDK2KDM4EMEN1LMNAMAPT

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-7088757-B1 Use of spiro compounds as laser dyes SEMICONDUCTORS GMBH (DE) 2006-08-08 US disclosed
EP-1053578-B1 USE OF SPIRO COMPOUNDS AS LASER DYES COVION ORGANIC SEMICONDUCTORS (DE) 2002-05-08 EP disclosed