SCHEMBL9692574

SCHEMBL9692574

CC(=O)NC1CCN(c2c(F)cc3c(=O)c(C(=O)O)c4n(c3c2F)C(C)S4)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 3/20 0.57
PIM1 P11309 2/20 0.57
GSK3A P49840 2/20 0.57
GSK3B P49841 2/20 0.57
CSNK1G1 Q9HCP0 2/20 0.57
LMNA P02545 2/20 0.41
PRKD3 O94806 2/20 0.41
IRAK1 P51617 1/20 0.41
RPS6KA3 P51812 1/20 0.41
DYRK1A Q13627 1/20 0.41
CSNK1G3 Q9Y6M4 1/20 0.41
DYRK3 O43781 1/20 0.40
SRPK1 Q96SB4 1/20 0.40
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
PMP22 Q01453 1/20 0.39
TOP1 P11387 1/20 0.37
SMPD3 Q9NY59 1/20 0.36

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
SCHEMBL9693618 0.91 PIM1 (0.59) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9693611 0.91 PIM1 (0.59) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9692654 0.91 PIM1 (0.55) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9692650 0.91 PIM1 (0.55) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9694287 0.88 PIM1 (0.53) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9694293 0.88 PIM1 (0.53) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9693946 0.85 PIM1 (0.77) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9615970 0.85 PIM1 (0.77) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9694104 0.85 PIM1 (0.77) PIM3PIM1GSK3AGSK3BCSNK1G1
SCHEMBL9694271 0.84 PIM1 (0.59) PIM3PIM1GSK3AGSK3BCSNK1G1

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
US-5126337-A Wide-spectrum bactericides HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1992-06-30 US disclosed