SCHEMBL14573232

SCHEMBL14573232

CC1(C)CC(=O)N(c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 20/20 1.00

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
SCHEMBL3389688 0.87 PARP1 (0.76) PARP1
SCHEMBL12798158 0.86 PARP1 (0.75) PARP1
SCHEMBL863338 0.84 PARP1 (0.92) PARP1
SCHEMBL29408705 0.84 PARP1 (0.92) PARP1
SCHEMBL4437930 0.84 PARP1 (1.00) PARP1
SCHEMBL3389570 0.83 PARP1 (0.71) PARP1
SCHEMBL3388610 0.83 PARP1 (1.00) PARP1
SCHEMBL24390012 0.83 PARP1 (0.70) PARP1
SCHEMBL29565339 0.83 PARP1 (0.70) PARP1
SCHEMBL3385144 0.83 PARP1 (0.80) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196085-B2 Phthalazinone derivatives KUDOS PHARMACEUTICALS LIMITED (GB) 2007-03-27 US disclosed
US-7196085-B2 Phthalazinone derivatives KUDOS PHARMACEUTICALS LIMITED (GB) 2007-03-27 US disclosed