SCHEMBL19736873

SCHEMBL19736873

Cc1nc2c(CO)cc(C3=CCOCC3)cn2c1Cc1cccc(C(F)(F)F)c1C

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.60
PIK3C2B O00750 17/20 0.60
PIK3CG P48736 12/20 0.60
PIK3CB P42338 9/20 0.49
MTOR P42345 12/20 0.46
PIK3CA P42336 4/20 0.46

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
SCHEMBL19736625 0.86 PIK3CD (0.61) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736845 0.84 PIK3CD (0.51) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736623 0.81 PIK3CD (0.69) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736883 0.81 PIK3CD (0.51) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736718 0.80 PIK3CD (0.63) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736880 0.80 PIK3CD (0.60) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736644 0.79 PIK3CD (0.61) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736878 0.79 PIK3CD (0.49) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736913 0.79 PIK3CD (0.61) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR
SCHEMBL19736968 0.77 PIK3CD (0.57) PIK3CDPIK3C2BPIK3CGPIK3CBMTOR

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
EP-3472160-B1 BICYCLIC PYRIDINE, PYRAZINE, AND PYRIMIDINE DERIVATIVES AS PI3K BETA INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-02-24 EP disclosed
US-10894793-B2 Bicyclic pyridine, pyrazine, and pyrimidine derivatives as PI3K beta inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-01-19 US disclosed
US-20190169199-A1 BICYCLIC PYRIDINE, PYRAZINE, AND PYRIMIDINE DERIVATIVES AS PI3K BETA INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2019-06-06 US disclosed
WO-2017216292-A1 BICYCLIC PYRIDINE, PYRAZINE, AND PYRIMIDINE DERIVATIVES AS PI3K BETA INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-12-21 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 (2 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-10894793-B2 Bicyclic pyridine, pyrazine, and pyrimidine derivatives as PI3K beta inhibitors PIK3CA, PIK3CD, PIK3CB PIK3CD 2/4885PIK3C2B 7/4885PIK3CG 5/4885
US-20190169199-A1 BICYCLIC PYRIDINE, PYRAZINE, AND PYRIMIDINE DERIVATIVES AS PI3K BETA INHIBITORS PIK3CA, PIK3CD, PIK3CB PIK3CD 2/4885PIK3C2B 7/4885PIK3CG 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.