SCHEMBL7847445

SCHEMBL7847445

CC(C)c1nc2cc(Cl)c(Cl)cc2nc1[S+]([O-])C(C)C

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 11/20 0.51
CCNT1 O60563 1/20 0.33
CDK9 P50750 1/20 0.33
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 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
SCHEMBL6310392 0.85 GLP1R (0.49) GLP1RCCNT1CDK9MMP1MMP2
SCHEMBL6307037 0.73 GLP1R (0.42) GLP1R
SCHEMBL6307860 0.73 GLP1R (0.53) GLP1R
SCHEMBL6305823 0.72 GLP1R (0.58) GLP1RCCNT1CDK9MMP1MMP2
SCHEMBL6304271 0.69 GLP1R (0.54) GLP1RCCNT1CDK9MMP1MMP2
SCHEMBL6306880 0.68 GLP1R (0.53) GLP1RCCNT1CDK9MMP1MMP2
SCHEMBL6307427 0.68 GLP1R (1.00) GLP1R
SCHEMBL6310949 0.63 GLP1R (0.73) GLP1R
SCHEMBL13748764 0.61
SCHEMBL12124147 0.61 MAPK13 (0.53) GLP1RMMP1MMP2MMP3

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-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