SCHEMBL11991048

SCHEMBL11991048

Cc1cc(C(F)(F)F)cc(P(=O)(c2ccc3c4ccccc4c4ccccc4c3c2)c2ccc3c4ccccc4c4ccccc4c3c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 2/20 0.38
PGK2 P07205 2/20 0.38
TAS2R14 Q9NYV8 1/20 0.36
KIF11 P52732 3/20 0.34
PTPN5 P54829 2/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
P2RX1 P51575 2/20 0.31
ADCY8 P40145 1/20 0.31
ADCY1 Q08828 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.30
P2RX3 P56373 1/20 0.30
P2RX4 Q99571 1/20 0.30
P2RX7 Q99572 1/20 0.30
NOTUM Q6P988 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
SCHEMBL11991045 0.96 MEN1 (0.38) PGK1PGK2TAS2R14KIF11PTPN5
SCHEMBL11991776 0.90 P2RX1 (0.37) PGK1PGK2KIF11P2RX1P2RX3
SCHEMBL11991129 0.84 PTPN5 (0.40) KIF11PTPN5MAPTKDM4EMEN1
SCHEMBL11991043 0.84 PTPN5 (0.40) KIF11PTPN5MAPTKDM4EMEN1
SCHEMBL19472451 0.83 PGK1 (0.43) PGK1PGK2TAS2R14KIF11PTPN5
SCHEMBL11991735 0.82 KIF11 (0.42) PGK1PGK2KIF11PTPN5RAB9A
SCHEMBL11991725 0.82 KIF11 (0.42) PGK1PGK2KIF11PTPN5RAB9A
SCHEMBL11991004 0.80 PTPN1 (0.36) PGK1PGK2TAS2R14PTPN5LMNA
SCHEMBL11990986 0.79 PTPN1 (0.35) PGK1PGK2TAS2R14LMNAP2RX1
SCHEMBL19472449 0.77 MAPK1 (0.45) PGK1PGK2TAS2R14PTPN5MAPT

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-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 US disclosed