SCHEMBL9618513

SCHEMBL9618513

O=P(O)(O)n1nnc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
ATM Q13315 1/20 0.52
DGAT1 O75907 1/20 0.47
SLC9A1 P19634 6/20 0.47
KEAP1 Q14145 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
MAPT P10636 1/20 0.47
CYP2C9 P11712 1/20 0.47
THPO P40225 1/20 0.47
CYP4Z1 Q86W10 1/20 0.47
MGAM O43451 5/20 0.46
AMY1A P0DUB6 5/20 0.46
GAA P10253 5/20 0.46
SI P14410 5/20 0.46
MGAM2 Q2M2H8 5/20 0.46
F2 P00734 1/20 0.46

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
SCHEMBL30363379 1.00 POLB (0.52) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL24744740 0.81 SLC9A1 (0.49) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL6048144 0.81 MAPT (0.52) POLBMAPK1ATMDGAT1SLC9A1
Phosphoric Acid SCHEMBL3485078 0.77 POLB (0.81) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL6048105 0.77 MAPT (0.47) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL19515117 0.74 POLB (0.75) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL6048104 0.73 MAPT (0.52) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL11088928 0.73 TSHR (0.50) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL3485080 0.73 TSHR (0.50) POLBMAPK1ATMDGAT1SLC9A1
SCHEMBL4260858 0.73 SLC9A1 (0.56) POLBSLC9A1MAPTCYP2C9MGAM

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
JP-4335209-A None JP disclosed
JP-H04335209-A MAGNETIC RECORDING MEDIUM HITACHI MAXELL LTD 1992-11-24 JP disclosed