SCHEMBL25649870

SCHEMBL25649870

O=c1[nH]nc(Cc2ccccc2I)c2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 15/20 0.68
▸ PARP1 P09874 1/20 0.62
▸ LMNA P02545 2/20 0.58
▸ HTT P42858 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ PRMT5 O14744 1/20 0.57
▸ TSHR P16473 1/20 0.56

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
SCHEMBL1075098 0.81 AR (1.00) ARPARP1LMNAHTTNPSR1
SCHEMBL12955524 0.81 AR (1.00) ARPARP1LMNAHTTNPSR1
SCHEMBL12955359 0.81 AR (1.00) ARPARP1LMNAHTTNPSR1
SCHEMBL12955377 0.81 AR (0.68) ARPARP1LMNAHTTNPSR1
SCHEMBL1076493 0.78 AR (1.00) ARPARP1LMNAHTTNPSR1
SCHEMBL28018259 0.78 AR (0.63) ARPARP1LMNAHTTNPSR1
SCHEMBL863462 0.77 AR (1.00) ARPARP1LMNAPRMT5TSHR
SCHEMBL21575704 0.76 PRMT5 (0.68) ARPARP1LMNAPRMT5TSHR
SCHEMBL19748630 0.76 AR (0.68) ARPARP1LMNAHTTNPSR1
SCHEMBL29655147 0.76 AR (0.68) ARPARP1LMNAHTTNPSR1

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-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 — — WO disclosed
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