SCHEMBL6312429

SCHEMBL6312429

CC(C)CCS(=O)(=O)c1nc2cc(Cl)ccc2nc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 4/20 0.47
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
S1PR1 P21453 2/20 0.33
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FABP4 P15090 1/20 0.31
DDR1 Q08345 1/20 0.31
TP53 P04637 1/20 0.31
GPR6 P46095 1/20 0.30

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
SCHEMBL6307183 1.00 GLP1R (0.47) GLP1RALDH1A1KDM4EMEN1USP2
SCHEMBL6306402 0.88 GLP1R (0.62) GLP1R
SCHEMBL6304255 0.73 HTT (0.41) ALDH1A1KDM4EMEN1USP2MAPT
SCHEMBL30753420 0.72 KDM4E (0.49) GLP1RALDH1A1KDM4EMEN1USP2
SCHEMBL6304313 0.68 KDM4E (0.45) GLP1RALDH1A1KDM4EMEN1USP2
SCHEMBL6304760 0.68 KDM4E (0.45) GLP1RALDH1A1KDM4EMEN1USP2
SCHEMBL11280556 0.67 GLP1R (0.54) GLP1RALDH1A1KDM4EMEN1USP2
SCHEMBL6307205 0.67 GLP1R (0.70) GLP1R
SCHEMBL6304517 0.67 GLP1R (0.56) GLP1RKDM4EMAPTKMT2AHSD17B10
SCHEMBL6306300 0.65 GLP1R (1.00) GLP1R

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
US-6927214-B1 Non-peptide GLP-1 agonists NOVO NORDISK A/S (DK) 2005-08-09 US disclosed
EP-1147094-A1 NON-PEPTIDE GLP-1 AGONISTS NOVO NORDISK A/S (DK) 2001-10-24 EP disclosed
WO-2000042026-A1 NON-PEPTIDE GLP-1 AGONISTS NOVO NORDISK A/S (DK) 2000-07-20 WO disclosed