SCHEMBL31650776

SCHEMBL31650776

Clc1nc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ATM Q13315 1/20 0.45
POLB P06746 3/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
GPR3 P46089 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
CYP19A1 P11511 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
APP P05067 2/20 0.35
PDE5A O76074 1/20 0.35
GALR3 O60755 1/20 0.34
NR2F2 P24468 1/20 0.34
RAB9A P51151 1/20 0.34
PTGER4 P35408 1/20 0.34
MAPT P10636 2/20 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
SCHEMBL11892606 1.00 KDM4E (0.45) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL29623840 1.00 KDM4E (0.45) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL11892607 0.96 KDM4E (0.45) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL29512936 0.96 KDM4E (0.45) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL29389255 0.89 KDM4E (0.54) KDM4EL3MBTL1ATMPOLBGPR3
SCHEMBL1303181 0.89 KDM4E (0.54) KDM4EL3MBTL1ATMPOLBGPR3
SCHEMBL16234063 0.87 KDM4E (0.43) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL29525742 0.86 KDM4E (0.44) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL15024927 0.86 KDM4E (0.44) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL29384326 0.86 KDM4E (0.44) KDM4EL3MBTL1ATMPOLBCTDSP1

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-2025132551-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2025-06-26 WO disclosed