SCHEMBL7011369

SCHEMBL7011369

NC1CCN(c2cc3c(cc2F)c(=O)n(OC(=O)C(F)(F)F)c(=O)n3-c2cc(F)c(F)cc2F)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 1/20 0.43
PIM1 P11309 1/20 0.43
GSK3A P49840 1/20 0.43
GSK3B P49841 1/20 0.43
IRAK1 P51617 1/20 0.43
RPS6KA3 P51812 1/20 0.43
DYRK1A Q13627 1/20 0.43
PIM3 Q86V86 1/20 0.43
CSNK1G3 Q9Y6M4 1/20 0.43
TOP1 P11387 7/20 0.41
DPP4 P27487 2/20 0.35
DPP8 Q6V1X1 2/20 0.35
DPP9 Q86TI2 2/20 0.35
DPP7 Q9UHL4 2/20 0.35
KMT2A Q03164 1/20 0.34
TOP2A P11388 6/20 0.34
TOP2B Q02880 4/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
CHRM2 P08172 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
SCHEMBL7014855 0.86 TOP1 (0.42) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL7008713 0.86 TOP1 (0.41) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL6803829 0.81 PIM1 (0.47) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL7013934 0.80 PRKD3 (0.39) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL7013172 0.76 TOP1 (0.47) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL7015316 0.75 GSK3B (0.34) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL7007951 0.72 MEN1 (0.50) KMT2AALDH1A1
SCHEMBL6803225 0.71 KMT2A (0.47) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL7012086 0.71 KMT2A (0.43) PRKD3PIM1GSK3AGSK3BIRAK1
SCHEMBL7015648 0.71 PIM1 (0.40) PRKD3PIM1GSK3AGSK3BIRAK1

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-1028950-B1 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 2003-05-02 EP claimed