SCHEMBL6212469

SCHEMBL6212469

O=C(O)Oc1cn(C2CC2)c2c(Cl)c(N3CC4CCCNC4C3)c(F)cc2c1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.64
ALDH1A1 P00352 5/20 0.64
HPGD P15428 5/20 0.64
HSD17B10 Q99714 3/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
POLB P06746 2/20 0.50
OPRM1 P35372 2/20 0.50
CHRM2 P08172 1/20 0.50
CHRM1 P11229 1/20 0.50
OPRD1 P41143 1/20 0.50
KCNH2 Q12809 5/20 0.43
PRKD3 O94806 1/20 0.43
ALOX15 P16050 1/20 0.43
CLK2 P49760 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP2C9 P11712 2/20 0.37
CYP3A4 P08684 1/20 0.37
LMNA P02545 2/20 0.35

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
SCHEMBL7502048 1.00 KDM4E (0.64) KDM4EALDH1A1HPGDHSD17B10MEN1
Hydrochloric Acid SCHEMBL6216048 0.99 KDM4E (0.65) KDM4EALDH1A1HPGDHSD17B10MEN1
Hydrochloric Acid SCHEMBL1859198 0.99 KDM4E (0.65) KDM4EALDH1A1HPGDHSD17B10MEN1
Sulfuric Acid SCHEMBL9570920 0.97 KDM4E (0.60) KDM4EALDH1A1HPGDHSD17B10MEN1
Citric Acid SCHEMBL9570761 0.92 ALDH1A1 (0.55) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL6211854 0.92 ALDH1A1 (0.68) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL9411014 0.92 ALDH1A1 (0.68) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL9411008 0.92 ALDH1A1 (0.68) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL6976037 0.91 ALDH1A1 (0.53) KDM4EALDH1A1HPGDHSD17B10MEN1
Hydrochloric Acid SCHEMBL9411049 0.91 ALDH1A1 (0.69) KDM4EALDH1A1HPGDHSD17B10MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757990-B1 7-(1-Pyrrolidoinyl)-3-quinolone and naphthyridone carboxylic acid derivatives, method for their preparation and for substituted mono- and bicyclic pyrrolidine intermediates, and their antibacterial and feed additive compositions BAYER HEALTHCARE AG (DE) 2005-03-30 EP disclosed
EP-0350733-B1 7-(1-Pyrrolidinyl)-3-quinolone- and -naphthyridone-carboxylic-acid derivatives, method for their preparation and for substituted mono- and bi-cyclic pyrrolidine intermediates, and their antibacterial and feed additive compositions BAYER AG (DE) 1997-08-20 EP disclosed
EP-0757990-A1 7-(1-Pyrrolidoinyl)-3-quinolone and naphthyridone carboxylic acid derivatives, method for their preparation and for substituted mono- and bicyclic pyrrolidine intermediates, and their antibacterial and feed additive compositions BAYER AG (DE) 1997-02-12 EP disclosed
EP-0350733-A2 7-(1-Pyrrolidinyl)-3-quinolone- and -naphthyridone-carboxylic-acid derivatives, method for their preparation and for substituted mono- and bi-cyclic pyrrolidine intermediates, and their antibacterial and feed additive compositions BAYER AG (DE) 1990-01-17 EP disclosed