SCHEMBL8324882

SCHEMBL8324882

CC(C)(C)ON=C1CN(c2c(C(=O)O)c(=O)c3cc(F)cc(Cl)c3n2C2CC2)CC1CN

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.42
DRD1 P21728 1/20 0.42
DPP4 P27487 1/20 0.42
KDM4E B2RXH2 1/20 0.39
ABCC4 O15439 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KCNH2 Q12809 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
SCHEMBL8473329 0.74 ALDH1A1 (0.58) CHRM2DRD1DPP4KDM4EABCC4
SCHEMBL8324880 0.74 ALDH1A1 (0.58) CHRM2DRD1DPP4KDM4EABCC4
Hydrochloric Acid SCHEMBL6005743 0.72 ALDH1A1 (0.48) CHRM2
SCHEMBL8324721 0.72 CHRM2 (0.60) CHRM2DRD1DPP4KDM4EABCC4
SCHEMBL8476554 0.72 CHRM2 (0.60) CHRM2DRD1DPP4KDM4EABCC4
SCHEMBL3315232 0.71 ALDH1A1 (0.43) CHRM2DPP4
SCHEMBL8323571 0.70 KCNH2 (0.65) CHRM2DRD1DPP4KDM4EABCC4
SCHEMBL8323573 0.70 KCNH2 (0.65) CHRM2DRD1DPP4KDM4EABCC4
SCHEMBL8325563 0.69 CHRM2 (0.60) CHRM2DRD1DPP4KDM4EABCC4
SCHEMBL8325560 0.69 CHRM2 (0.60) CHRM2DRD1DPP4KDM4EABCC4

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-0688772-B1 Quinoline carboxylic acid derivatives having 7-(4-amino-methyl-3-oxime) pyrrolidine substituents and processes for their preparation LG CHEMICAL LTD (KR) 1999-05-06 EP disclosed
US-5633262-A BACTERICIDES LG CHEMICAL LTD. (KR) 1997-05-27 US disclosed
EP-0688772-A1 Novel quinoline carboxylic acid derivatives having 7-(4-amino-methyl-3-oxime) pyrrolidine substituents and processes for their preparation LG Chemical Limited (KR) 1995-12-27 EP disclosed