SCHEMBL9523005

SCHEMBL9523005

CC1Sc2c(C(=O)O)c(=O)c3cc(Cl)c(N4CCN(C)CC4)cc3n21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
PIM1 P11309 2/20 0.42
GSK3A P49840 2/20 0.42
GSK3B P49841 2/20 0.42
PIM3 Q86V86 2/20 0.42
PRKD3 O94806 1/20 0.42
IRAK1 P51617 1/20 0.42
RPS6KA3 P51812 1/20 0.42
DYRK1A Q13627 1/20 0.42
CSNK1G3 Q9Y6M4 1/20 0.42
ALDH1A1 P00352 3/20 0.39
DRD3 P35462 2/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 4/20 0.36
NPC1 O15118 3/20 0.36
HPGD P15428 1/20 0.36
RAD52 P43351 2/20 0.33
MAPT P10636 1/20 0.33
GAA P10253 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
SCHEMBL9523658 0.89 LMNA (0.51) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9523392 0.88 LMNA (0.68) LMNAPIM1GSK3AGSK3BPIM3
Sulfuric Acid SCHEMBL9523234 0.84 LMNA (0.64) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9522306 0.84 LMNA (0.64) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9525764 0.81 ALDH1A1 (0.40) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9522209 0.79 LMNA (0.67) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL10564853 0.78 LMNA (0.66) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9525041 0.78 LMNA (0.66) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9522445 0.77 LMNA (0.70) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9522257 0.77 LMNA (0.44) LMNAALDH1A1MEN1KMT2AKDM4E

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