SCHEMBL6311925

SCHEMBL6311925

CC(C)(C)Nc1nc2cc(C(F)(F)F)cc(Cl)c2nc1S(C)(=O)=O

nearest known ligand 0.91

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 12/20 0.91
KIF20B Q96Q89 1/20 0.37
CCNE2 O96020 2/20 0.36
CCNE1 P24864 2/20 0.36
CDK2 P24941 2/20 0.36
CCNA2 P20248 1/20 0.36
CCNA1 P78396 1/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 3/20 0.35
HTT P42858 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL31673865 0.77 GLP1R (1.00) GLP1R
SCHEMBL2555049 0.77 GLP1R (1.00) GLP1R
SCHEMBL6311921 0.77 GLP1R (0.60) GLP1RKIF20BPOLBLMNAHTT
SCHEMBL6305960 0.65 GLP1R (0.74) GLP1R
SCHEMBL6311574 0.65 GLP1R (0.69) GLP1RCCNE2CCNE1CDK2
SCHEMBL20636784 0.65 KIF20B (0.48) GLP1RKIF20BPOLBHTT
SCHEMBL5819225 0.64 ALDH1A1 (0.61) GLP1RPOLBLMNAHTTL3MBTL1
SCHEMBL9768068 0.62 GLP1R (0.45) GLP1R
SCHEMBL11273612 0.62 GLP1R (0.41) GLP1RHTT
SCHEMBL3660278 0.61 KIF20B (0.50) GLP1RKIF20BPOLBHTTL3MBTL1

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
US-6927214-B1 Non-peptide GLP-1 agonists NOVO NORDISK A/S (DK) 2005-08-09 US claimed
US-6927214-B1 Non-peptide GLP-1 agonists NOVO NORDISK A/S (DK) 2005-08-09 US disclosed