SCHEMBL20123398

SCHEMBL20123398

COCCN1CN(Cc2ccc(F)cc2)n2cc(C)c(=O)c(O)c2C1=O

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL2600940 0.88 CHRM1 (0.38) KDM4EALDH1A1HPGDTDP1
SCHEMBL19220550 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL4166026 0.80 SLC22A2 (0.51)
SCHEMBL19220540 0.80
SCHEMBL19220537 0.79
SCHEMBL10442768 0.79 HTT (0.38)
SCHEMBL2601286 0.77 POLB (0.39) MAPTALDH1A1
SCHEMBL4166008 0.76 SLC22A2 (0.49)
SCHEMBL2601289 0.76 KDM4E (0.39) KDM4EALDH1A1
SCHEMBL4164661 0.75 SLC22A2 (0.50)

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-2620436-B1 SUBSTITUTED POLYCYCLIC CARBAMOYL PYRIDONE DERIVATIVE PRODRUG SHIONOGI & CO (JP) 2018-05-09 EP disclosed