SCHEMBL802386

SCHEMBL802386

Cc1ccccc1-c1cc(-c2ccncc2)nc(Nc2cc(C3CC3)[nH]n2)n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 16/20 0.50
NEK1 Q96PY6 1/20 0.45

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
SCHEMBL801689 0.86 IGF1R (0.48) IGF1RNEK1
SCHEMBL12620022 0.85 IGF1R (0.47) IGF1RNEK1
SCHEMBL802122 0.85 AURKA (0.49) IGF1R
SCHEMBL801760 0.84 IGF1R (0.47) IGF1RNEK1
SCHEMBL802725 0.84 IGF1R (0.46) IGF1RNEK1
SCHEMBL802732 0.77 GSK3B (0.56) IGF1R
SCHEMBL801683 0.76 IGF1R (0.46) IGF1RNEK1
SCHEMBL13221090 0.75 MAP4K2 (0.52) IGF1RNEK1
SCHEMBL802320 0.75 GSK3B (0.55) IGF1R
SCHEMBL802337 0.74 GRM4 (0.45)

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-8633210-B2 Triazole compounds useful as protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-01-21 US disclosed
US-20120071657-A1 TRIAZOLE COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-03-22 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-20120071657-A1 TRIAZOLE COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS GSK3B, GSK3A, CDK19 IGF1R 293/4885NEK1 270/4885

“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.