SCHEMBL9568360

SCHEMBL9568360

O=C(O)c1c2n(c3cc(-c4ccccc4)c(F)cc3c1=O)C(c1ccc(F)cc1)S2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
PRKD3 O94806 1/20 0.35
PIM1 P11309 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
IRAK1 P51617 1/20 0.35
RPS6KA3 P51812 1/20 0.35
DYRK1A Q13627 1/20 0.35
PIM3 Q86V86 1/20 0.35
CSNK1G3 Q9Y6M4 1/20 0.35
MEN1 O00255 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
NLRP3 Q96P20 1/20 0.34
TUBB P07437 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
SCHEMBL9568303 0.95 LMNA (0.37) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568427 0.91 PRKD3 (0.36) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568382 0.89 LMNA (0.35) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568423 0.89 TOP1 (0.35) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568393 0.88 PRKD3 (0.36) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568463 0.87 ALDH1A1 (0.44) LMNAMEN1RAB9AKMT2A
SCHEMBL9568461 0.87 LMNA (0.36) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568450 0.85 LMNA (0.35) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568353 0.85 TOP1 (0.36) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9568381 0.83 LMNA (0.49) 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