SCHEMBL23958121

SCHEMBL23958121

O=c1c2cc(I)ccc2nc(Nc2cccnc2)n1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 1/20 0.43
RAD52 P43351 1/20 0.42
KMT2A Q03164 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
PDE7A Q13946 1/20 0.40
MAPT P10636 1/20 0.40
MDM2 Q00987 1/20 0.39
PSD A5PKW4 1/20 0.39
USP2 O75604 1/20 0.38
PDE5A O76074 1/20 0.38

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
SCHEMBL23958142 0.92 POLB (0.42) RAD52KMT2ACA12CA1CA2
SCHEMBL30103264 0.87 MDM2 (0.49) ALOX12RAD52KMT2AMAPTMDM2
SCHEMBL29738614 0.87 PIK3CD (0.46) ALOX12RAD52KMT2APDE7APDE5A
SCHEMBL30025728 0.87 TUBB4A (0.45) ALOX12RAD52KMT2A
SCHEMBL23958215 0.87 MDM2 (0.49) ALOX12RAD52KMT2AMAPTMDM2
SCHEMBL24110981 0.87 ALOX12 (0.43) ALOX12RAD52KMT2APDE7AMAPT
SCHEMBL23958265 0.87 PIK3CD (0.46) ALOX12RAD52KMT2APDE7APDE5A
SCHEMBL23958278 0.87 TUBB4A (0.45) ALOX12RAD52KMT2A
SCHEMBL24110995 0.86 ALOX12 (0.57) ALOX12RAD52KMT2APDE7AMAPT
SCHEMBL24110973 0.85 ALOX12 (0.47) ALOX12RAD52KMT2APDE7AMAPT

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