SCHEMBL31301800

SCHEMBL31301800

CCc1cnc2c(O)ccc(Cl)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.47
LMNA P02545 2/20 0.47
BRD4 O60885 1/20 0.47
HSP90AA1 P07900 1/20 0.47
MAPT P10636 1/20 0.47
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
TRPA1 O75762 1/20 0.39
PARP1 P09874 1/20 0.38
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA6 P23280 2/20 0.36
CA7 P43166 2/20 0.36
CA13 Q8N1Q1 2/20 0.36
IDO1 P14902 1/20 0.35

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
SCHEMBL31301909 0.88 KDM4E (0.45) KDM4ELMNABRD4HSP90AA1MAPT
SCHEMBL31301969 0.85 NPC1 (0.46) KDM4ELMNABRD4HSP90AA1MAPT
SCHEMBL31301815 0.83 KDM4E (0.44) KDM4ELMNABRD4HSP90AA1MAPT
SCHEMBL11688674 0.78 MAPT (0.51) KDM4ELMNABRD4HSP90AA1MAPT
SCHEMBL31301792 0.74 KDM4E (0.47) KDM4ELMNABRD4HSP90AA1MAPT
SCHEMBL31301943 0.74 MAPT (0.47) KDM4ELMNABRD4HSP90AA1MAPT
SCHEMBL23490733 0.70 MASP2 (0.38) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL4463430 0.70 KDM4E (0.62) KDM4EMETAP2METAP1PDE4DPARP1
SCHEMBL28961849 0.69 PDE4A (0.36) PDE4APDE4BPDE4CPDE4DPARP1
SCHEMBL31114570 0.69 PARP1 (0.39) KDM4EPDE4APDE4BPDE4CPDE4D

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
CN-119390735-A Hydroxyquinoline coordinated catalyst, preparation method, composite catalyst and application 上海元革新材料科技有限公司 2025-02-07 CN disclosed