SCHEMBL4602918

SCHEMBL4602918

CCCCc1ncc(CO)n1-c1ccc(-c2ccccc2)c(-c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.40
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.31

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
SCHEMBL3873970 0.92 AGTR1 (0.46) AGTR1
SCHEMBL3884082 0.78 AGTR1 (0.48) AGTR1
SCHEMBL3873751 0.75 AGTR1 (0.48) AGTR1
SCHEMBL4960875 0.73 AGTR1 (0.55) AGTR1
SCHEMBL3872809 0.72 AGTR1 (0.51) AGTR1
SCHEMBL3872191 0.70 AGTR1 (0.54) AGTR1
SCHEMBL3425230 0.70 AGTR1 (0.59) AGTR1
SCHEMBL2161550 0.70 ABCG2 (0.41) AGTR1POLBSMN1; SMN2ADORA3ADORA2A
SCHEMBL30743612 0.69 ABCG2 (0.55) AGTR1POLBSMN1; SMN2ABCG2
SCHEMBL3407499 0.69 AGTR1 (0.61) AGTR1

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-1899328-A1 A PROCESS FOR THE PREPARATION OF LOSARTAN DERIVATIVES BY CHLORINATION AND REDUCTION OF THE RESPECTIVE 1H-IMIDAZOLE-5-CARBALDEHYDES KRKA, D.D., Novo Mesto (SI) 2008-03-19 EP disclosed
WO-2007003280-A1 A PROCESS FOR THE PREPARATION OF LOSARTAN DERIVATIVES BY CHLORINATION AND REDUCTION OF THE RESPECTIVE 1H-IMIDAZOLE-5-CARBALDEHYDES KRKA, D.D. NOVO MESTO (SI) 2007-01-11 WO disclosed