SCHEMBL1552686

SCHEMBL1552686

NC(=O)Oc1ccc2[nH]c(-c3ccc(OC4CCC(O)CC4)cc3)nc2c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 18/20 0.67
MAP4K4 O95819 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
SCHEMBL1551690 0.94 CHEK2 (0.68) CHEK2
SCHEMBL1553042 0.89 CHEK2 (0.67) CHEK2
SCHEMBL1552249 0.87 CHEK2 (0.84) CHEK2MAP4K4
SCHEMBL1552280 0.86 CHEK2 (0.69) CHEK2
SCHEMBL1553038 0.85 CHEK2 (0.69) CHEK2
SCHEMBL1553024 0.85 CHEK2 (0.69) CHEK2
SCHEMBL1552362 0.85 CHEK2 (0.70) CHEK2
SCHEMBL1552252 0.83 CHEK2 (0.69) CHEK2
SCHEMBL1552337 0.83 CHEK2 (0.69) CHEK2
SCHEMBL1551725 0.81 CHEK2 (0.85) CHEK2

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
EP-1824832-B1 ARYL-SUBSTITUTED BENZIMIDAZOLE AND IMIDAZOPYRIDINE ETHERS AS ANTI-CANCER AGENTS JANSSEN PHARMACEUTICA NV (BE) 2011-04-27 EP claimed