SCHEMBL7207839

SCHEMBL7207839

CC(C)(NOC(C)(C)c1ccccc1)C(=O)OP(N)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.38
ALDH1A1 P00352 2/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC3 O15379 2/20 0.34
HDAC4 P56524 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC7 Q8WUI4 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC10 Q969S8 2/20 0.34
HDAC11 Q96DB2 2/20 0.34
HDAC8 Q9BY41 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC9 Q9UKV0 2/20 0.34
HDAC5 Q9UQL6 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PTPN1 P18031 2/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL7212937 0.77 NPC1 (0.47) ALDH1A1MAPTKMT2ASMN1; SMN2PTPN1
SCHEMBL7212927 0.75 S1PR4 (0.38) ALDH1A1MAPK1MAPTSMN1; SMN2POLB
SCHEMBL28889636 0.70 ALDH1A1 (0.52) KCNN4ALDH1A1ALOX15MAPK1MAPT
SCHEMBL25291817 0.69 MAPT (0.52) KCNN4ALDH1A1ALOX15MAPK1MAPT
SCHEMBL112703 0.65 MAPT (0.55) KCNN4ALDH1A1ALOX15MAPK1MAPT
SCHEMBL8849102 0.65 ALDH1A1 (0.54) KCNN4ALDH1A1ALOX15MAPK1MAPT
SCHEMBL1014613 0.65 ALDH1A1 (0.54) KCNN4ALDH1A1ALOX15MAPK1MAPT
SCHEMBL7208533 0.64 CYP2C19 (0.39) KCNN4MAPK1MAPTKMT2ASMN1; SMN2
SCHEMBL8913938 0.63 MAPK1 (0.50) KCNN4ALDH1A1ALOX15MAPK1MAPT
SCHEMBL28004816 0.63 ALDH1A1 (0.52) KCNN4ALDH1A1ALOX15MAPK1MAPT

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
EP-1150988-B1 PHOSPHORAMIDATE, AND MONO-, DI-, AND TRI-PHOSPHATE ESTERS OF (1R, CIS)-4-(6-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL AGENTS GLAXO GROUP LTD (GB) 2003-05-28 EP claimed