SCHEMBL9782104

SCHEMBL9782104

O=P(Oc1ccccc1)(Oc1ccccc1)ON1CCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 1/20 0.39
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL2858596 0.92 SRC (0.52) SRCL3MBTL1TDP1KDM4ENPSR1
SCHEMBL2852435 0.84 LMNA (0.44) SRCL3MBTL1TDP1NPSR1MAPT
SCHEMBL8466411 0.84 SRC (0.44) SRCL3MBTL1TDP1KDM4ENPSR1
SCHEMBL3677566 0.76 LMNA (0.40) SRCL3MBTL1TDP1KDM4ENPSR1
Triphenyl Phosphate SCHEMBL28557783 0.75 SRC (0.64) SRCL3MBTL1TDP1KDM4ENPSR1
Triphenyl Phosphate SCHEMBL483692 0.75 SRC (0.64) SRCL3MBTL1TDP1KDM4ENPSR1
Triphenyl Phosphate SCHEMBL28761613 0.75 SRC (0.64) SRCL3MBTL1TDP1KDM4ENPSR1
Triphenyl Phosphate SCHEMBL18116 0.75 SRC (0.64) SRCL3MBTL1TDP1KDM4ENPSR1
Triphenyl Phosphate SCHEMBL7202263 0.73 SRC (0.70) SRCL3MBTL1TDP1KDM4EMEN1
Triphenyl Phosphate SCHEMBL9622348 0.73 SRC (0.70) SRCL3MBTL1TDP1KDM4EMEN1

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-4992544-A Intermediates for b-lactam antibiotics and b-lactamase inhibitor UNIVERSITY OF NOTRE DAME DU LAC (US) 1991-02-12 US disclosed