SCHEMBL4744280

SCHEMBL4744280

NP(=O)(O)Oc1cccnc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
LMNA P02545 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
FDPS P14324 6/20 0.42
HTT P42858 1/20 0.41
KMT2A Q03164 2/20 0.41
ALOX15 P16050 1/20 0.41
BTN3A1 O00481 1/20 0.40
PDE3A Q14432 1/20 0.40
F7 P08709 1/20 0.40
F3 P13726 1/20 0.40
SARM1 Q6SZW1 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
SIRT6 Q8N6T7 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
SIRT3 Q9NTG7 1/20 0.40
SIRT5 Q9NXA8 1/20 0.40
SIRT4 Q9Y6E7 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SRC P12931 1/20 0.39

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
SCHEMBL28219782 0.85 SRC (0.57) SMN1; SMN2LMNATDP1FDPSHTT
SCHEMBL10932461 0.85 SMN1; SMN2 (0.47) SMN1; SMN2LMNATDP1HTTKMT2A
SCHEMBL4744278 0.85 SMN1; SMN2 (0.47) SMN1; SMN2LMNATDP1HTTKMT2A
SCHEMBL28096006 0.81 SMN1; SMN2 (0.45) SMN1; SMN2LMNATDP1FDPSHTT
SCHEMBL27714398 0.79 KMT2A (0.45) SMN1; SMN2LMNATDP1FDPSHTT
SCHEMBL18301043 0.77 SMN1; SMN2 (0.42) SMN1; SMN2LMNATDP1FDPSHTT
SCHEMBL27647649 0.77 FDPS (0.45) SMN1; SMN2LMNATDP1FDPSHTT
SCHEMBL220525 0.76 SRC (0.67) TDP1ALDH1A1SRC
SCHEMBL4679260 0.74 FDPS (0.44) SMN1; SMN2LMNATDP1FDPSHTT
SCHEMBL27998020 0.73 LMNA (0.43) SMN1; SMN2LMNATDP1HTTKMT2A

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
CN-107148423-B Thionucleoside derivative or salt thereof and pharmaceutical composition 富士胶片株式会社 2021-07-30 CN disclosed
CN-107148423-A Thionucleoside derivatives or its salt and medical composition 富士胶片株式会社 2017-09-08 CN disclosed
WO-2008113161-A1 PHOSPHATE PRODRUGS OF QUINAZOLINYL NITROFURANS, METHODS OF OBTAINING, AND USE OF SAME ULYSSES PHARMACEUTICAL PRODUCTS INC. (CA) 2008-09-25 WO disclosed