SCHEMBL19035560

SCHEMBL19035560

CNC1CCN(c2cnccn2)C1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 15/20 0.53
KDM4E B2RXH2 1/20 0.52
HRH3 Q9Y5N1 1/20 0.48
RXFP1 Q9HBX9 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
SCHEMBL8693976 0.90 KDM4E (0.58) HRH4KDM4ERXFP1
SCHEMBL81467 0.79 HRH4 (0.57) HRH4HRH3
SCHEMBL13035375 0.79 KDM4E (0.52) KDM4ERXFP1
SCHEMBL13118511 0.78 HRH4 (0.57) HRH4HRH3
SCHEMBL28850160 0.77 HRH4 (0.59) HRH4HRH3
SCHEMBL4287133 0.76 HRH4 (0.64) HRH4HRH3
SCHEMBL24928451 0.76 KDM4E (0.52) KDM4ERXFP1
SCHEMBL1267664 0.76 KDM4E (0.49) KDM4ERXFP1
SCHEMBL30718898 0.76 KDM4E (0.52) KDM4ERXFP1
SCHEMBL27140276 0.76 KDM4E (0.52) KDM4ERXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10301267-B2 Compounds ASTRAZENECA AB (SE) 2019-05-28 US disclosed
US-20170260143-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2017-09-14 US disclosed
US-9688640-B2 Methods of treating cancer with a pyrazole derivative ASTRAZENECA AB (SE) 2017-06-27 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 (2 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-10301267-B2 Compounds SLC10A1, CYP11B1, ABCB11 HRH4 3347/4885KDM4E 2865/4885HRH3 3986/4885
US-20170260143-A1 NOVEL COMPOUNDS SLC10A1, ABCB11, CYP11B1 HRH4 3520/4885KDM4E 3393/4885HRH3 3902/4885

“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.