SCHEMBL9523317

SCHEMBL9523317

CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)c2n3C(c3ccccc3F)S2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.51
PRKD3 O94806 1/20 0.47
PIM1 P11309 1/20 0.47
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
IRAK1 P51617 1/20 0.47
RPS6KA3 P51812 1/20 0.47
DYRK1A Q13627 1/20 0.47
PIM3 Q86V86 1/20 0.47
CSNK1G3 Q9Y6M4 1/20 0.47
ALDH1A1 P00352 8/20 0.47
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
DRD3 P35462 1/20 0.47
KDM4E B2RXH2 9/20 0.44
HPGD P15428 3/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.41
RAD52 P43351 1/20 0.41
HTT P42858 2/20 0.40

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
SCHEMBL9523549 0.93 LMNA (0.51) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9522225 0.91 LMNA (0.52) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9525499 0.91 LMNA (0.52) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL10569034 0.90 LMNA (0.51) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9523415 0.90 LMNA (0.51) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9523539 0.88 LMNA (0.50) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL10567712 0.86 LMNA (0.55) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9523012 0.86 LMNA (0.49) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9523182 0.85 LMNA (0.51) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9522744 0.85 LMNA (0.53) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0249043-B1 QUINOLINECARBOXYLIC ACID DERIVATIVES NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-08-04 EP disclosed
US-4843070-A BACTERIDCIDES, FUNGICIDES NIPPON SHINYAKU CO., LTD. (JP) 1989-06-27 US disclosed
EP-0249043-A2 Quinolinecarboxylic acid derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1987-12-16 EP disclosed