SCHEMBL19632932

SCHEMBL19632932

Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@H](O)C1(Cl)Cl

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADK P55263 1/20 0.54
ADORA2A P29274 1/20 0.48
PRMT5 O14744 16/20 0.47
WDR77 Q9BQA1 12/20 0.47
METTL3 Q86U44 1/20 0.46

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
SCHEMBL19636420 1.00 ADK (0.54) ADKADORA2APRMT5WDR77METTL3
SCHEMBL14154369 0.89 ADK (0.52) ADKADORA2APRMT5WDR77METTL3
SCHEMBL18480770 0.89 ADK (0.52) ADKADORA2APRMT5WDR77METTL3
SCHEMBL18470916 0.89 ADK (0.52) ADKADORA2APRMT5WDR77METTL3
SCHEMBL16480592 0.89 ADK (0.52) ADKADORA2APRMT5WDR77METTL3
SCHEMBL6841559 0.88 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL12150845 0.88 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL731889 0.88 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL12154683 0.88 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL10208018 0.87 ADK (0.55) ADKADORA2APRMT5WDR77METTL3

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-20170334941-A1 2',2'-DIHALO NUCLEOSIDE ANALOGS FOR TREATMENT OF THE FLAVIVIRIDAE FAMILY OF VIRUSES AND CANCER EMORY UNIVERSITY 2017-11-23 US disclosed
US-20170334941-A1 2',2'-DIHALO NUCLEOSIDE ANALOGS FOR TREATMENT OF THE FLAVIVIRIDAE FAMILY OF VIRUSES AND CANCER EMORY UNIVERSITY 2017-11-23 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-20170334941-A1 2',2'-DIHALO NUCLEOSIDE ANALOGS FOR TREATMENT OF THE FLAVIVIRIDAE FAMILY OF VIRUSES AND CANCER HAVCR2, DERA, EIF2AK2 ADK 220/4885ADORA2A 139/4885PRMT5 3830/4885

“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.