SCHEMBL11991042

SCHEMBL11991042

O=P(c1cc(F)cc(F)c1)(c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2)c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 10/20 0.36
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
SCHEMBL11991039 1.00 PDK2 (0.36) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20593956 0.92 AKR1A1 (0.30)
SCHEMBL11991040 0.89 PDK2 (0.42) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL11991037 0.89 PDK2 (0.42) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL2969076 0.89 KDM4E (0.37) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20249889 0.85 PDK2 (0.43) PDK2LMNA
SCHEMBL23634544 0.85 MEN1 (0.45) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL132071 0.84 LMNA (0.39) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL17928303 0.84 LMNA (0.39) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL29842660 0.84 LMNA (0.39) 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-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 US disclosed
US-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 US disclosed