SCHEMBL26018436

SCHEMBL26018436

CCN1CCCc2c1nc(I)[nH]c2=O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.40
▸ TNKS O95271 16/20 0.36
▸ PARP1 P09874 16/20 0.36
▸ TNKS2 Q9H2K2 16/20 0.36
▸ INMT O95050 1/20 0.33
▸ HPGD P15428 1/20 0.33

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
SCHEMBL20954967 0.82 POLB (0.40) POLBTNKSPARP1TNKS2INMT
SCHEMBL26018017 0.80 TNKS (0.48) TNKSPARP1TNKS2
SCHEMBL26018420 0.72 HPRT1 (0.36) POLBTNKSPARP1TNKS2INMT
SCHEMBL17086636 0.65 HPGD (0.49) POLBTNKSPARP1TNKS2HPGD
SCHEMBL26017824 0.65 HPGD (0.53) POLBTNKSPARP1TNKS2HPGD
SCHEMBL20955537 0.64 TNKS (0.34) TNKSPARP1TNKS2HPGD
SCHEMBL20954788 0.62 TNKS (0.51) TNKSPARP1TNKS2
SCHEMBL26018020 0.62 UHRF1 (0.42) TNKSPARP1HPGD
SCHEMBL18635 0.61 — —
SCHEMBL27958225 0.61 PIK3CD (0.59) INMT

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-2023156386-A2 PHARMACEUTICAL COMPOUND Duke Street Bio Limited (GB) 2023-08-24 — — WO disclosed
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