SCHEMBL23958142

SCHEMBL23958142

O=c1c2cc(I)ccc2nc(Nc2cccnc2)n1-c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
PIK3CD O00329 1/20 0.38
PDE5A O76074 2/20 0.38
KMT2A Q03164 2/20 0.37
RAD52 P43351 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL24110971 0.92 POLB (0.46) POLBPIK3CDPDE5AKMT2ARAD52
SCHEMBL23958121 0.92 ALOX12 (0.43) CA12CA1CA2CA9PDE5A
SCHEMBL29738614 0.87 PIK3CD (0.46) POLBPIK3CDPDE5AKMT2ARAD52
SCHEMBL23958265 0.87 PIK3CD (0.46) POLBPIK3CDPDE5AKMT2ARAD52
SCHEMBL30103265 0.86 POLB (0.50) POLBPIK3CDMAPT
SCHEMBL24110913 0.86 POLB (0.50) POLBPIK3CDMAPT
SCHEMBL24111022 0.86 PIK3CD (0.42) POLBPIK3CD
SCHEMBL23958245 0.85 PIK3CD (0.50) PIK3CDKMT2ARAD52
SCHEMBL30103245 0.85 PIK3CD (0.50) PIK3CDKMT2ARAD52
SCHEMBL24110807 0.83 PIK3CD (0.45) PIK3CDMAPT

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-2021215537-A1 2-HETEROARYLAMINOQUINAZOLINONE DERIVATIVE 大日本住友製薬株式会社 (JP) 2021-10-28 WO disclosed