SCHEMBL2566751

SCHEMBL2566751

CSc1nc(-c2cccc(Cl)c2Cl)c2c(C#N)c[nH]c2n1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 12/20 0.61
KCNH2 Q12809 4/20 0.53
CHUK O15111 3/20 0.46
LRRK2 Q5S007 2/20 0.46
HSP90AA1 P07900 2/20 0.44

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
SCHEMBL12161192 0.82 HSP90AB1 (0.67) HSP90AB1KCNH2HSP90AA1
SCHEMBL2568739 0.79 HSP90AB1 (0.59) HSP90AB1KCNH2CHUKHSP90AA1
SCHEMBL2563341 0.78 HSP90AB1 (0.79) HSP90AB1KCNH2CHUKLRRK2
SCHEMBL2566096 0.78 HSP90AB1 (0.70) HSP90AB1KCNH2HSP90AA1
SCHEMBL2568418 0.77 HSP90AB1 (0.75) HSP90AB1KCNH2HSP90AA1
SCHEMBL12161020 0.77 KCNH2 (0.70) HSP90AB1KCNH2HSP90AA1
SCHEMBL13798718 0.76 HSP90AB1 (0.57) HSP90AB1KCNH2HSP90AA1
SCHEMBL14421907 0.76 CHUK (0.61) HSP90AB1KCNH2CHUKLRRK2HSP90AA1
SCHEMBL2563404 0.76 HSP90AB1 (1.00) HSP90AB1KCNH2CHUKLRRK2HSP90AA1
SCHEMBL31296689 0.76 HSP90AB1 (1.00) HSP90AB1KCNH2CHUKLRRK2HSP90AA1

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
EP-2007767-B1 PYRROLOPYRIMIDINE DERIVATIVES USED AS HSP90 INHIBITORS VERNALIS R&D LTD (GB) 2011-11-02 EP disclosed
US-20090163490-A1 Pyrrolopyrimidine Derivatives Used As HSP90 Inhibitors VERNALIS (R&D) LTD. (GB) 2009-06-25 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-20090163490-A1 Pyrrolopyrimidine Derivatives Used As HSP90 Inhibitors HSP90AA1, HSP90AB1, RAF1 HSP90AB1 2/4885KCNH2 2202/4885CHUK 258/4885

“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.