SCHEMBL6987475

SCHEMBL6987475

CCCC(F)OC(=O)C1CCCN1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.48
DPP7 Q9UHL4 1/20 0.46
TLR2 O60603 2/20 0.41
HTR2C P28335 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
IDO1 P14902 1/20 0.34
GPR88 Q9GZN0 1/20 0.34
HTR2A P28223 2/20 0.34
HTR2B P41595 1/20 0.34
TERT O14746 1/20 0.33
DPP4 P27487 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL19687949 0.83 DPP7 (0.47) PRCPDPP7TLR2CYP1A2CYP3A4
SCHEMBL19687950 0.83 DPP7 (0.47) PRCPDPP7TLR2CYP1A2CYP3A4
SCHEMBL14315876 0.83 DPP7 (0.47) PRCPDPP7TLR2CYP1A2CYP3A4
SCHEMBL3781423 0.79 NOS2 (0.39) PRCPDPP7TLR2HTR2CCYP1A2
SCHEMBL3781419 0.79 NOS2 (0.39) PRCPDPP7TLR2HTR2CCYP1A2
SCHEMBL21105823 0.77 PRCP (0.56) PRCPDPP7TLR2
SCHEMBL28014192 0.77 DPP7 (0.53) PRCPDPP7TLR2CYP1A2CYP3A4
SCHEMBL14887225 0.76 PRCP (0.44) PRCPDPP7TLR2HTR2CCYP1A2
SCHEMBL14887354 0.76 PRCP (0.44) PRCPDPP7TLR2HTR2CCYP1A2
SCHEMBL14887236 0.76 PRCP (0.44) PRCPDPP7TLR2HTR2CCYP1A2

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-1315698-A1 PYRROLIDINES AS INHIBITORS OF NEURAMINIDASES ABBOTT LABORATORIES (US) 2003-06-04 EP disclosed
WO-1999054299-A1 PYRROLIDINES AS INHIBITORS OF NEURAMINIDASES ABBOTT LABORATORIES (US) 1999-10-28 WO disclosed