SCHEMBL29922956

SCHEMBL29922956

CC(C)(C)OC(=O)CCCCCCCCCCC(=O)N1CCN(C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)CC1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 20/20 0.71
▸ TNKS O95271 3/20 0.69
▸ TNKS2 Q9H2K2 3/20 0.69

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
SCHEMBL24624758 1.00 PARP1 (0.71) PARP1TNKSTNKS2
SCHEMBL29923122 1.00 PARP1 (0.71) PARP1TNKSTNKS2
SCHEMBL23113133 0.90 PARP1 (0.65) PARP1TNKSTNKS2
SCHEMBL29535734 0.89 PARP1 (0.75) PARP1TNKSTNKS2
SCHEMBL22656867 0.89 PARP1 (0.75) PARP1TNKSTNKS2
SCHEMBL28975588 0.89 PARP1 (0.81) PARP1TNKSTNKS2
SCHEMBL29923010 0.88 PARP1 (0.76) PARP1TNKSTNKS2
SCHEMBL29922994 0.88 PARP1 (0.76) PARP1TNKSTNKS2
SCHEMBL23113221 0.87 PARP1 (0.75) PARP1TNKSTNKS2
SCHEMBL30293105 0.87 PARP1 (0.89) PARP1TNKSTNKS2

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
WO-2022148822-A1 USP5 BINDING SURVIVAL-TARGETING CHIMERIC (SURTAC) MOLECULES & USES THEREOF LOCKI THERAPEUTICS LIMITED (GB) 2022-07-14 — — WO disclosed
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