SCHEMBL1597048

SCHEMBL1597048

COc1ccccc1-n1c(Cn2ccc(=O)c3c(N)ncnc32)nc2cccc(Cl)c2c1=O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.52
PIK3CG P48736 11/20 0.52
PIK3CB P42338 7/20 0.52
PIK3R1 P27986 3/20 0.50
PIK3CA P42336 5/20 0.46
ABL1 P00519 1/20 0.42
SRC P12931 1/20 0.42
MTOR P42345 1/20 0.42
PRKDC P78527 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
PIK3R2 O00459 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
SCHEMBL12560352 0.89 PIK3CD (0.63) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA
SCHEMBL732491 0.86 PIK3CD (0.69) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA
SCHEMBL9604072 0.77 PIK3CD (0.84) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA
SCHEMBL733839 0.76 PIK3CD (0.75) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA
SCHEMBL734099 0.76 PIK3CG (0.59) PIK3CDPIK3CGPIK3CBL3MBTL1
SCHEMBL18923577 0.76 L3MBTL1 (0.69) PIK3CDPIK3CGPIK3CBL3MBTL1
SCHEMBL27764713 0.75 PIK3CD (0.47) PIK3CDPIK3CGPIK3CBPIK3R1L3MBTL1
SCHEMBL733167 0.75 PIK3CD (0.86) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA
SCHEMBL733097 0.74 PIK3CD (0.70) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA
SCHEMBL733332 0.73 PIK3CD (0.69) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152277-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES CHEN YI 2011-06-23 US disclosed
US-20110152277-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES CHEN YI 2011-06-23 US disclosed
US-7919498-B2 Substituted pyrazolo[3,4-d]pyrimidines as PI3K inhibitors AMGEN INC. (US) 2011-04-05 US disclosed
US-7919498-B2 Substituted pyrazolo[3,4-d]pyrimidines as PI3K inhibitors AMGEN INC. (US) 2011-04-05 US disclosed
US-7919498-B2 Substituted pyrazolo[3,4-d]pyrimidines as PI3K inhibitors AMGEN INC. (US) 2011-04-05 US disclosed
EP-2132207-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2009-12-16 EP disclosed
US-20090030002-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-01-29 US disclosed
US-20090030002-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-01-29 US disclosed
US-20090030002-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-01-29 US disclosed
WO-2008118454-A2 DERIVATIVES OF QUINOLINE OR BENZOPYRAZINE AND THEIR USES FOR THE TREATMENT OF (INTER ALIA) INFLAMMATORY DISEASES, AUTOIMMUNE DISEASES OR VARIOUS KINDS OF CANCER AMGEN INC. (US) 2008-10-02 WO disclosed
WO-2008118454-A2 DERIVATIVES OF QUINOLINE OR BENZOPYRAZINE AND THEIR USES FOR THE TREATMENT OF (INTER ALIA) INFLAMMATORY DISEASES, AUTOIMMUNE DISEASES OR VARIOUS KINDS OF CANCER AMGEN INC. (US) 2008-10-02 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-20110152277-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 PIK3CD 16/4885PIK3CG 54/4885PIK3CB 35/4885
US-20090030002-A1 Heterocyclic compounds and their uses MCL1, BCL9, MALT1 PIK3CD 15/4885PIK3CG 53/4885PIK3CB 37/4885

“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.