SCHEMBL9101233

SCHEMBL9101233

CC(=NNC(N)=O)c1ccc2nnc(C(C)c3ccc4ncccc4c3)n2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 1.00
PDE1A P54750 1/20 0.53
PDE4C Q08493 1/20 0.53
PDE4D Q08499 1/20 0.53
PDE3B Q13370 1/20 0.53
PDE1C Q14123 1/20 0.53
PDE3A Q14432 1/20 0.53
PDE11A Q9HCR9 1/20 0.53
PDE10A Q9Y233 1/20 0.53

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
SCHEMBL9101214 1.00 MET (1.00) METPDE1APDE4CPDE4DPDE3B
SCHEMBL10162658 1.00 MET (1.00) METPDE1APDE4CPDE4DPDE3B
SCHEMBL9101223 1.00 MET (1.00) METPDE1APDE4CPDE4DPDE3B
SCHEMBL10162661 1.00 MET (1.00) METPDE1APDE4CPDE4DPDE3B
SCHEMBL9103720 0.86 MET (1.00) MET
SCHEMBL9103732 0.86 MET (1.00) MET
SCHEMBL10162563 0.86 MET (1.00) MET
SCHEMBL9103739 0.86 MET (1.00) MET
SCHEMBL10162564 0.86 MET (1.00) MET
SCHEMBL1163925 0.85 MET (0.74) METPDE1APDE4CPDE4DPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497368-B2 Heterocyclic hydrazone compounds NOVARTIS AG (CH) 2013-07-30 US disclosed
US-20120142681-A1 HETEROCYCLIC HYDRAZONE COMPOUNDS NOVARTIS AG (CH) 2012-06-07 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-20120142681-A1 HETEROCYCLIC HYDRAZONE COMPOUNDS MET, HGF, RET MET 1/4885PDE1A 3037/4885PDE4C 3475/4885

“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.