SCHEMBL4070203

SCHEMBL4070203

Nc1ncnc2cc(CN3CCN(Cc4cc(-c5ccc(Cl)s5)no4)CC3=O)ccc12

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.61
PDPK1 O15530 1/20 0.33
PLA2G2A P14555 2/20 0.32

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
Trifluoroacetic Acid SCHEMBL4061423 0.93 F10 (0.55) F10PDPK1
SCHEMBL4065113 0.88 F10 (0.60) F10
SCHEMBL4390958 0.88 F10 (0.63) F10PDPK1
SCHEMBL1387023 0.87 F10 (0.64) F10PDPK1
SCHEMBL4065702 0.85 F10 (0.46) F10
SCHEMBL1653302 0.84 F10 (0.59) F10PDPK1PLA2G2A
SCHEMBL1386342 0.84 F10 (0.61) F10PDPK1
SCHEMBL4389436 0.83 F10 (0.58) F10PDPK1PLA2G2A
Trifluoroacetic Acid SCHEMBL4061928 0.82 F10 (0.54) F10
SCHEMBL1653141 0.81 F10 (0.62) F10PDPK1PLA2G2A

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-1208097-B1 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMA INC (US) 2009-02-18 EP claimed