SCHEMBL1192121

SCHEMBL1192121

CC(C)(O)c1nc2nc(Cl)nc(N3CCOCC3)c2s1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 12/20 0.40
MTOR P42345 7/20 0.40
PIK3CD O00329 3/20 0.40
PIK3CB P42338 2/20 0.40
PIK3CG P48736 2/20 0.40
SYK P43405 1/20 0.40
MAP3K9 P80192 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
PIK3R1 P27986 7/20 0.36
ALOX15 P16050 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
ADORA2A P29274 1/20 0.32

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
SCHEMBL8061257 0.81 SMN1; SMN2 (0.42) PIK3CAMTORSMN1; SMN2PIK3R1ALOX15
SCHEMBL1194347 0.80 SMN1; SMN2 (0.42) PIK3CAPIK3CDPIK3CBSMN1; SMN2PIK3R1
SCHEMBL1192753 0.80 SMN1; SMN2 (0.38) PIK3CAMTORPIK3CDPIK3CBPIK3CG
SCHEMBL1192450 0.78 ALOX15 (0.51) PIK3CAPIK3CDPIK3CBPIK3CGSMN1; SMN2
SCHEMBL2673640 0.77 PIK3CD (0.61) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL1192419 0.77 SMN1; SMN2 (0.39) PIK3CAMTORSMN1; SMN2PIK3R1ALOX15
SCHEMBL1192248 0.76 KDM4E (0.42) PIK3CAMTORSMN1; SMN2PIK3R1ALOX15
SCHEMBL1192367 0.76 PIK3CA (0.45) PIK3CAMTORPIK3CDPIK3CGSMN1; SMN2
SCHEMBL1192759 0.76 PIK3CA (0.68) PIK3CAMTORPIK3CDPIK3CBPIK3CG
SCHEMBL1285174 0.76 PIK3CA (0.63) PIK3CAMTORPIK3CDPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2207781-B1 THIAZOLOPYRIMIDINE P13K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2012-11-28 EP disclosed
US-8158626-B2 Thiazolopyrimidine PI3K inhibitor compounds and methods of use F. HOFFMANN-LA ROCHE AG (CH) 2012-04-17 US disclosed
US-20110112085-A1 THIAZOLOPYRIMIDINE PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2011-05-12 US disclosed
US-7893059-B2 Thiazolopyrimidine PI3K inhibitor compounds and methods of use GENENTECH, INC. (US) 2011-02-22 US disclosed
EP-2207781-A1 THIAZOLOPYRIMIDINE P13K INHIBITOR COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2010-07-21 EP disclosed
US-20090118275-A1 THIAZOLOPYRIMIDINE P13K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2009-05-07 US disclosed
WO-2009042607-A1 THIAZOLOPYRIMIDINE P13K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2009-04-02 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-20110112085-A1 THIAZOLOPYRIMIDINE PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3CA, PIK3CD, PIK3CB PIK3CA 1/4885MTOR 13/4885PIK3CD 2/4885
US-20090118275-A1 THIAZOLOPYRIMIDINE P13K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3CA, PI4KB, PI4KA PIK3CA 1/4885MTOR 59/4885PIK3CD 11/4885

“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.