SCHEMBL993475

SCHEMBL993475

CC(C)(C)OC(=O)N1CCOC2(CCN(Cc3cc4nc(Cl)nc(N5CCOCC5)c4s3)CC2)C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.45
PIK3CA P42336 7/20 0.43
PIK3R1 P27986 1/20 0.43
PIK3CB P42338 4/20 0.41
PIK3CG P48736 4/20 0.41
CYP3A4 P08684 3/20 0.40
CHRM2 P08172 1/20 0.40
CHRM3 P20309 1/20 0.40

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
SCHEMBL994383 0.93 PIK3CD (0.45) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL993496 0.90 PIK3CD (0.46) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL466290 0.88 PIK3CD (0.52) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL994008 0.88 PIK3CD (0.46) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL994312 0.86 PIK3CD (0.47) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL994269 0.83 PIK3CA (0.44) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL994553 0.82 PIK3CD (0.48) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL1497337 0.82 RECQL (0.48) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL1088548 0.80 PIK3CD (0.48) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG
SCHEMBL994547 0.79 PIK3CD (0.46) PIK3CDPIK3CAPIK3R1PIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2205610-B1 THIENOPYRIMIDIENE DERIVATIVES AS PI3K INHIBITORS HOFFMANN LA ROCHE (CH) 2013-11-20 EP disclosed
US-8293735-B2 Thienopyrimidine derivatives as P13K inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2012-10-23 US disclosed
US-8293735-B2 Thienopyrimidine derivatives as P13K inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2012-10-23 US disclosed
US-8293735-B2 Thienopyrimidine derivatives as P13K inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2012-10-23 US disclosed
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-01-27 US disclosed
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-01-27 US disclosed
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-01-27 US disclosed
WO-2009053715-A1 THIENOPYRIMIDIENE DERIVATIVES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-04-30 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-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS PIK3CA, PIK3CD, PIK3CB PIK3CD 2/4885PIK3CA 1/4885PIK3R1 16/4885

“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.