SCHEMBL9666136

SCHEMBL9666136

CCCCOC(=O)N1CCC(C(O)S(C)(=O)=O)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
MMP13 P45452 7/20 0.41
MMP3 P08254 6/20 0.41
MMP9 P14780 6/20 0.41
MMP2 P08253 5/20 0.41
MMP8 P22894 5/20 0.41
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
GPR119 Q8TDV5 2/20 0.37
MMP1 P03956 4/20 0.37
MMP7 P09237 3/20 0.37
PDE4B Q07343 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 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
SCHEMBL12468859 0.80 SMN1; SMN2 (0.47) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL12468609 0.80 SMN1; SMN2 (0.47) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL2361594 0.80 LMNA (0.49) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL30543794 0.78 LMNA (0.48) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL29850834 0.77 LMNA (0.56) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL29429485 0.77 LMNA (0.47) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL2360585 0.77 SMN1; SMN2 (0.47) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL31131213 0.77 SMN1; SMN2 (0.47) SMN1; SMN2LMNAPOLBMMP13MMP3
SCHEMBL9022812 0.77 GPR119 (0.45) MMP13MMP3MMP9MMP2MMP8
SCHEMBL29356156 0.76 LMNA (0.46) SMN1; SMN2LMNAPOLBMMP13MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0500835-A1 A NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVE. DAE WOONG PHARMA (KR) 1992-09-02 EP disclosed
WO-1992004342-A1 A NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVE DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 1992-03-19 WO disclosed