SCHEMBL9929110

SCHEMBL9929110

COc1c(C(C)N(C(=O)O)C(C)(C)C)cc(Cl)c(C)c1C1CN(C(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 7/20 0.38

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
SCHEMBL9929335 0.86 PIK3CD (0.36) PIK3CD
SCHEMBL9929267 0.82 PIK3CD (0.38) PIK3CD
SCHEMBL9928886 0.82 PIK3CD (0.50) PIK3CD
SCHEMBL9928935 0.80 PIK3CD (0.45) PIK3CD
SCHEMBL17333103 0.77 IMPDH2 (0.32)
SCHEMBL9928938 0.77 IMPDH2 (0.32)
Hydrochloric Acid SCHEMBL9929198 0.76 PIK3CD (0.46) PIK3CD
SCHEMBL9929001 0.75 IMPDH2 (0.32)
SCHEMBL14736691 0.72 PIK3CD (0.42) PIK3CD
SCHEMBL14736290 0.72 PIK3CD (0.42) PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157430-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION 2012-06-21 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-20120157430-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PI4KB PIK3CD 2/4885

“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.