SCHEMBL9417142

SCHEMBL9417142

CCOP(=O)(COCCOn1cnc2c(Cl)ncnc21)OCC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.41
SLC22A6 Q4U2R8 2/20 0.39
ABCB11 O95342 1/20 0.39
POLA1 P09884 1/20 0.39
POLG P54098 1/20 0.39
FAP Q12884 1/20 0.39
FGFR1 P11362 8/20 0.34
FGFR4 P22455 6/20 0.34
ENPP1 P22413 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
P2RX7 Q99572 2/20 0.33
NT5E P21589 1/20 0.33
DGAT1 O75907 1/20 0.32
HSP90AA1 P07900 2/20 0.31
HSP90AB1 P08238 2/20 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
SCHEMBL9858079 0.93 FDPS (0.40) FDPSSLC22A6ABCB11POLA1POLG
SCHEMBL9417160 0.86 SLC22A6 (0.50) SLC22A6ABCB11POLA1POLGFAP
SCHEMBL9683381 0.85 FDPS (0.42) FDPSFGFR1FGFR4HDAC6P2RX7
SCHEMBL9683394 0.84 FDPS (0.41) FDPSFGFR1FGFR4HDAC6P2RX7
SCHEMBL9858339 0.80 FGFR1 (0.50) SLC22A6ABCB11POLA1POLGFAP
SCHEMBL9417258 0.79
SCHEMBL9857669 0.78 ABCB11 (0.36) FDPSSLC22A6ABCB11POLA1POLG
SCHEMBL9417208 0.76 CDK1 (0.43) SLC22A6ABCB11POLA1POLGFAP
SCHEMBL9417250 0.76 FDPS (0.37) FDPSSLC22A6ABCB11POLA1POLG
SCHEMBL9127128 0.76 FAP (0.48) SLC22A6ABCB11POLA1POLGFAP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0319228-B1 Novel compounds BEECHAM GROUP PLC (GB) 1994-11-02 EP disclosed
US-5247085-A Phosphonate containing purine compounds BEECHAM GROUP P.L.C. (GB) 1993-09-21 US disclosed
EP-0319228-A2 Novel compounds BEECHAM GROUP PLC (GB) 1989-06-07 EP disclosed