SCHEMBL16701520

SCHEMBL16701520

Nc1ncnc2c1c(-c1cc(O)cc(F)c1)nn2CCNCc1ccccc1F

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 6/20 0.73
PIK3CG P48736 10/20 0.57
PIK3C2B O00750 7/20 0.57
BTK Q06187 1/20 0.52

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
SCHEMBL16701591 0.89 PIK3CD (0.78) PIK3CDPIK3CGPIK3C2BBTK
SCHEMBL16701728 0.86 PIK3CD (0.70) PIK3CDPIK3CGPIK3C2BBTK
SCHEMBL16701439 0.84 PIK3CD (1.00) PIK3CDPIK3CGPIK3C2BBTK
SCHEMBL16701498 0.84 PIK3CD (0.67) PIK3CDPIK3CGPIK3C2BBTK
SCHEMBL16701518 0.79 PIK3CD (0.65) PIK3CDPIK3CGPIK3C2B
SCHEMBL16701651 0.78 PIK3CD (0.60) PIK3CDPIK3CGPIK3C2BBTK
SCHEMBL16702636 0.77 PIK3CD (0.55) PIK3CDPIK3CGPIK3C2B
SCHEMBL16701898 0.76 PIK3CD (0.56) PIK3CDPIK3CGPIK3C2BBTK
SCHEMBL16701638 0.76 PIK3CD (0.59) PIK3CDPIK3CGBTK
SCHEMBL16701914 0.75 PIK3CD (0.62) PIK3CDPIK3CGPIK3C2BBTK

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-20160272645-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2016-09-22 US disclosed
WO-2015069441-A1 PYRAZOLO-, IMIDAZOLO- AND PYRROLO-PYRIDINE OR -PYRIMIDINE DERIVATIVES AS INHIBITORS O BRUTONS KINASE (BTK) MEDIVATION TECHNOLOGIES, INC. (US) 2015-05-14 WO 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-20160272645-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB PIK3CD 2/4885PIK3CG 8/4885PIK3C2B 5/4885

“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.