SCHEMBL18384668

SCHEMBL18384668

COc1c2cccnc2c(OC)c2oc(C(C)O)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 2/20 0.37
NSD2 O96028 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
PABPC1 P11940 1/20 0.36
CASP7 P55210 1/20 0.36
SYK P43405 1/20 0.35
RAD52 P43351 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
G6PD P11413 1/20 0.35
BRD4 O60885 1/20 0.34
SLC40A1 Q9NP59 1/20 0.34
CCR1 P32246 1/20 0.34
CCR8 P51685 1/20 0.34
KDM4E B2RXH2 3/20 0.34
HTT P42858 3/20 0.34
LMNA P02545 2/20 0.34

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
SCHEMBL18384636 0.95 CASP6 (0.37) CASP6NSD2HSP90AA1HSP90AB1PABPC1
SCHEMBL21237006 0.84 CASP6 (0.39) CASP6NSD2HSP90AA1HSP90AB1PABPC1
SCHEMBL21237001 0.81 HSP90AA1 (0.35) CASP6NSD2HSP90AA1HSP90AB1PABPC1
SCHEMBL18384665 0.78 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL18384670 0.78 KDM4E (0.41) CASP6NSD2PABPC1CASP7PDE4A
SCHEMBL18384666 0.77 KDM4E (0.44) CASP6HSP90AA1PABPC1CASP7PDE4A
SCHEMBL18384664 0.75 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL18384651 0.75 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL18384637 0.73 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL18384608 0.73 HSP90AA1 (0.36) CASP6NSD2HSP90AA1HSP90AB1PABPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10934309-B2 Tricyclic quinone derivative SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. (US) 2021-03-02 US disclosed
US-20190241583-A1 NEW TRICYCLIC QUINONE DERIVATIVE SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. 2019-08-08 US disclosed
EP-3127907-A1 NEW TRICYCLIC QUINONE DERIVATIVE Boston Biomedical, Inc. (US) 2017-02-08 EP disclosed
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE BOSTON BIOMEDICAL, INC. (US) 2017-01-19 US disclosed
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE BOSTON BIOMEDICAL, INC. (US) 2017-01-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190241583-A1 NEW TRICYCLIC QUINONE DERIVATIVE NQO1, SQOR, SULT1E1 CASP6 3962/4885NSD2 958/4885HSP90AA1 2704/4885
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE NQO1, SQOR, SULT1E1 CASP6 3962/4885NSD2 958/4885HSP90AA1 2704/4885
US-10934309-B2 Tricyclic quinone derivative NQO1, NQO2, SQOR CASP6 4211/4885NSD2 836/4885HSP90AA1 3013/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.