SCHEMBL9501196

SCHEMBL9501196

CCOC(=O)C(=CNC1CC1)C(=O)c1c(F)cc(F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
DHODH Q02127 3/20 0.35
POLB P06746 1/20 0.35
GAA P10253 5/20 0.34
TDP1 Q9NUW8 2/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
CYP2D6 P10635 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
STAT1 P42224 1/20 0.33
CYP3A4 P08684 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
SCHEMBL1348749 0.93 POLB (0.39) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL1348752 0.93 POLB (0.39) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL5505218 0.92 POLB (0.37) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL5505216 0.92 POLB (0.37) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL8925690 0.88 NPSR1 (0.38) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL8925686 0.88 NPSR1 (0.38) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL1345391 0.88 CYP2D6 (0.38) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL9562436 0.88 CYP2D6 (0.38) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL1345392 0.88 CYP2D6 (0.38) NPSR1MAPTMEN1KMT2ALMNA
SCHEMBL10400402 0.87 NPSR1 (0.36) NPSR1MAPTMEN1KMT2ALMNA

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-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