SCHEMBL4697402

SCHEMBL4697402

CCCC(CCC)C(=O)Nc1ccc2c(Cc3cccc(F)c3)n[nH]c(=O)c2c1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 19/20 0.57

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
SCHEMBL4704345 0.90 PARP1 (0.58) PARP1
SCHEMBL4698407 0.85 PARP1 (0.72) PARP1
SCHEMBL4700129 0.84 LMNA (0.51) PARP1
SCHEMBL4698690 0.82 PARP1 (0.55) PARP1
SCHEMBL4702676 0.81 PARP1 (0.48) PARP1
SCHEMBL4697638 0.81 PARP1 (0.48) PARP1
SCHEMBL4700307 0.81 PARP1 (0.55) PARP1
SCHEMBL4700486 0.80 PARP1 (0.49) PARP1
SCHEMBL4699193 0.79 PARP1 (0.59) PARP1
SCHEMBL4700866 0.79 PARP1 (0.52) PARP1

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-1427708-B1 AMINO-PHTHALAZINONE DERIVATIVES AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PFIZER ITALIA SRL (IT) 2008-09-10 EP claimed