SCHEMBL9501167

SCHEMBL9501167

CCOC(=O)c1cn(C2CC2)c2cc(F)c(F)c(N(Cc3ccccc3)C(C)=O)c2c1=O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.43
GSK3B P49841 6/20 0.42
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KCNH2 Q12809 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
HTT P42858 1/20 0.39
GNRHR P30968 6/20 0.39

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
SCHEMBL9502058 0.83 ADRB2 (0.48) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL9501129 0.81 ADRB2 (0.51) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL30181222 0.81 ADRB2 (0.50) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL5507636 0.81 ADRB2 (0.50) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL1345409 0.78 ADRB2 (0.43) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL9501304 0.78 GSK3B (0.49) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL263981 0.78 STAT3 (0.48) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL9501162 0.77 ADRB2 (0.46) ADRB2GSK3BALDH1A1LMNAMAPT
SCHEMBL1344567 0.75 HSD17B10 (0.46) ADRB2GSK3BKDM4EALDH1A1LMNA
SCHEMBL9268553 0.75 MAOB (0.41) ADRB2GSK3BKDM4EALDH1A1HPGD

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-0312085-B1 NOVEL QUINOLINE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND ANTIBACTERIAL AGENT CONTAINING THEM Dainippon Pharmaceutical Co., Ltd. (JP) 1993-05-12 EP disclosed
US-5164392-A Active against streptococci and staphylococci DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1992-11-17 US disclosed
US-5013841-A Oxo quinoline derivatives DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1991-05-07 US disclosed
EP-0312085-A2 Novel quinoline derivatives, processes for preparation thereof and antibacterial agent containing them Dainippon Pharmaceutical Co., Ltd. (JP) 1989-04-19 EP disclosed