SCHEMBL9568425

SCHEMBL9568425

CC1Sc2c(C(=O)O)c(=O)c3cc(F)c(-c4ccc(CNC(=O)CN)cc4)cc3n21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
PRKD3 O94806 1/20 0.37
PIM1 P11309 1/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
IRAK1 P51617 1/20 0.37
RPS6KA3 P51812 1/20 0.37
DYRK1A Q13627 1/20 0.37
PIM3 Q86V86 1/20 0.37
CSNK1G3 Q9Y6M4 1/20 0.37
TOP1 P11387 1/20 0.35
BACE1 P56817 2/20 0.34
MAPK14 Q16539 1/20 0.34
AOC3 Q16853 2/20 0.33
ALDH2 P05091 1/20 0.33
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAG3 Q9UGI9 1/20 0.32

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
SCHEMBL9568426 0.89 LMNA (0.46) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568327 0.89 LMNA (0.47) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568452 0.89 LMNA (0.44) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568399 0.88 LMNA (0.43) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568332 0.87 LMNA (0.49) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568404 0.84 LMNA (0.47) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568396 0.84 LMNA (0.49) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568326 0.84 LMNA (0.46) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568367 0.84 LMNA (0.46) LMNAPRKD3PIM1GSK3AGSK3B
Hydrochloric Acid SCHEMBL9568307 0.83 LMNA (0.47) LMNAPRKD3PIM1GSK3AGSK3B

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-0551518-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-07-21 EP disclosed