SCHEMBL9152067

SCHEMBL9152067

CCOC(=O)c1c(C(C)C)nc(OC)c(C(=O)OC)c1-c1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 5/20 0.61
GAA P10253 3/20 0.48
POLB P06746 1/20 0.48
SLC10A2 Q12908 1/20 0.47
HTT P42858 1/20 0.44
GRM6 O15303 1/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GPR55 Q9Y2T6 1/20 0.43
ALDH1A1 P00352 4/20 0.43
NPSR1 Q6W5P4 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TP53 P04637 1/20 0.41

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
SCHEMBL9737768 0.89 GCGR (0.64) GCGRGAAPOLBSLC10A2HTT
SCHEMBL2662902 0.89 GCGR (0.55) GCGRGAAPOLBSLC10A2HTT
SCHEMBL8178136 0.89 GCGR (0.64) GCGRGAAPOLBSLC10A2HTT
SCHEMBL13482768 0.89 GCGR (0.64) GCGRGAAPOLBSLC10A2HTT
SCHEMBL2648212 0.87 GCGR (0.62) GCGRGAAPOLBSLC10A2HTT
SCHEMBL3192181 0.87 GCGR (0.61) GCGRGAAPOLBSLC10A2HTT
SCHEMBL2648326 0.86 GCGR (0.66) GCGRGAAPOLBSLC10A2GRM6
SCHEMBL2647128 0.85 GCGR (0.51) GCGRGAAPOLBSLC10A2HTT
SCHEMBL9149631 0.85 GCGR (0.56) GCGRGAAPOLBSLC10A2HTT
SCHEMBL6565362 0.83 GCGR (0.79) GCGRNPC1LMNARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5418243-A Anticholesterol agents BAYER AKTIENGESELLSCHAFT (DE) 1995-05-23 US disclosed