SCHEMBL26018337

SCHEMBL26018337

O=c1[nH]c(I)nc2ncncc12

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.44
HCAR2 Q8TDS4 1/20 0.31
PARP1 P09874 2/20 0.31
METAP2 P50579 1/20 0.30
METAP1 P53582 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL12102096 0.79 PDE5A (0.47) PDE5APARP1
SCHEMBL13833239 0.79 KDM4E (0.49) PDE5AMEN1KMT2A
SCHEMBL1623385 0.75 PDE5A (0.44) PDE5AHCAR2PARP1
SCHEMBL26018347 0.74 KDM4C (0.35) HCAR2PARP1MEN1KMT2A
SCHEMBL3663889 0.73 PDE5A (0.41) PDE5AHCAR2
SCHEMBL7787137 0.73 METAP2 (0.47) METAP2METAP1
SCHEMBL26017631 0.71 HCAR2 (0.59) HCAR2PARP1
SCHEMBL29774108 0.69 PDE5A (0.37) PDE5AMEN1KMT2A
SCHEMBL30593810 0.68 SMN1; SMN2 (0.48) PDE5APARP1
SCHEMBL7017053 0.68 SMN1; SMN2 (0.48) PDE5APARP1

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