SCHEMBL20015946

SCHEMBL20015946

O=c1c2nc(Sc3ccc(Cl)cc3)n(C3OC4COPOC4C3O)c2nc2[nH]c(-c3ccccc3)cn12

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.59
PDE4A P27815 11/20 0.45
PDE4B Q07343 11/20 0.45
PDE4C Q08493 11/20 0.45
PDE4D Q08499 11/20 0.45
PRKACA P17612 2/20 0.44
PRKACG P22612 2/20 0.44
PRKACB P22694 2/20 0.44
BLM P54132 1/20 0.44
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
RAPGEF3 O95398 1/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL25930772 0.93 TDP1 (0.59) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930822 0.93 TDP1 (0.57) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930563 0.91 TDP1 (0.57) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930837 0.89 TDP1 (0.58) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930507 0.88 TDP1 (0.57) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930652 0.87 TDP1 (0.56) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930757 0.86 TDP1 (0.57) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930575 0.86 TDP1 (0.56) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL25930915 0.86 TDP1 (0.64) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL20015943 0.86 TDP1 (0.74) TDP1PDE4APDE4BPDE4CPDE4D

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
US-20180085311-A1 TARGETED LIPOSOMAL DELIVERY OF CGMP ANALOGUES MIRECA MEDICINES GMBH (DE) 2018-03-29 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 (1 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-20180085311-A1 TARGETED LIPOSOMAL DELIVERY OF CGMP ANALOGUES PDE6C, PDE2A, GMPS TDP1 1835/4885PDE4A 19/4885PDE4B 21/4885

“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.