SCHEMBL13828396

SCHEMBL13828396

Cc1cccc2oc(Cn3cnc4c(N)ncnc43)c(-c3cccc(F)c3)c(=O)c12

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.48
PIK3R1 P27986 2/20 0.48
PIK3CB P42338 1/20 0.48
PIK3CG P48736 1/20 0.48
NSD2 O96028 4/20 0.42
PI4KA P42356 1/20 0.41
PI4K2B Q8TCG2 1/20 0.41
PI4K2A Q9BTU6 1/20 0.41
PI4KB Q9UBF8 1/20 0.41

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
SCHEMBL13729010 0.91 NSD2 (0.43) PIK3CDPIK3R1PIK3CGNSD2PI4KA
SCHEMBL30013691 0.88 PIK3CD (0.46) PIK3CDPIK3R1PIK3CGNSD2PI4KA
SCHEMBL8426 0.88 PIK3CD (0.46) PIK3CDPIK3R1PIK3CGNSD2PI4KA
SCHEMBL30013561 0.88 NSD2 (0.44) PIK3CDPIK3R1PIK3CBPIK3CGNSD2
SCHEMBL8080 0.88 NSD2 (0.44) PIK3CDPIK3R1PIK3CBPIK3CGNSD2
SCHEMBL13725952 0.83 ADORA2A (0.44) PIK3CDPIK3R1PIK3CGNSD2PI4KA
SCHEMBL8903 0.81 ADORA2A (0.49) PIK3CDPIK3R1PIK3CBPIK3CGNSD2
SCHEMBL30013159 0.81 ADORA2A (0.49) PIK3CDPIK3R1PIK3CBPIK3CGNSD2
SCHEMBL16783886 0.80 PI4KA (0.46) PIK3CDPIK3R1PIK3CBPIK3CGNSD2
SCHEMBL8575 0.79 ADORA2A (0.46) PIK3CDPIK3R1PIK3CGNSD2PI4KA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2018-04-26 US disclosed
US-9775841-B2 Compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2017-10-03 US disclosed
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2015-11-12 US disclosed
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-11-15 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 (3 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-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PIK3CD 47/4885PIK3R1 102/4885PIK3CB 23/4885
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PIK3CD 47/4885PIK3R1 102/4885PIK3CB 23/4885
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PIK3CD 47/4885PIK3R1 102/4885PIK3CB 23/4885

“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.