SCHEMBL754017

SCHEMBL754017

Cc1ccccc1-n1c(C(C)N)nc2cccc(C)c2c1=O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.64
PIK3R1 P27986 3/20 0.59
PIK3CG P48736 5/20 0.47
PIK3CB P42338 3/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PIK3CA P42336 1/20 0.43
TSHR P16473 1/20 0.41

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
SCHEMBL20717712 1.00 PIK3CD (0.64) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1
SCHEMBL13161373 0.89 PIK3CD (0.60) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1
SCHEMBL15812924 0.87 PIK3CD (0.60) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL15812927 0.87 PIK3CD (0.60) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL16583419 0.86 PIK3CD (0.60) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1
SCHEMBL754924 0.86 PIK3CD (0.60) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1
SCHEMBL13007621 0.85 PIK3CD (0.58) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1
SCHEMBL28436002 0.82 PIK3CD (0.53) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1
SCHEMBL28436003 0.82 PIK3CD (0.53) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1
SCHEMBL20703745 0.82 PIK3CD (0.52) PIK3CDPIK3R1PIK3CGPIK3CBALDH1A1

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11459306-B2 Compounds, compositions, and methods for treating T-cell acute lymphoblastic leukemia THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2022-10-04 US disclosed
CN-111386264-A Compounds, compositions and methods for treating T-cell acute lymphoblastic leukemia 纽约市哥伦比亚大学理事会 2020-07-07 CN disclosed
US-10695349-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2020-06-30 US disclosed
EP-3661924-A1 COMPOUNDS, COMPOSITIONALS, AND METHODS FOR TREATING T-CELL ACUTE LYMPHOBLASTIC LEUKEMIA The Trustees of Columbia University in the City of New York (US) 2020-06-10 EP disclosed
US-20200165211-A1 Compounds, Compositions, and Methods for Treating T-Cell Acute Lymphoblastic Leukemia THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2020-05-28 US disclosed
US-20200061062-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2020-02-27 US disclosed
US-10398695-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2019-09-03 US disclosed
WO-2019028055-A1 COMPOUNDS, COMPOSITIONALS, AND METHODS FOR TREATING T-CELL ACUTE LYMPHOBLASTIC LEUKEMIA THE TRUSTEES OF COLUMBIA UNIVERISTY IN THE CITY OF NEW YORK (US) 2019-02-07 WO disclosed
US-10010550-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2018-07-03 US disclosed
US-10010550-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2018-07-03 US disclosed
US-8492389-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2013-07-23 US disclosed
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2012-07-05 US disclosed
US-20120135994-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2012-05-31 US disclosed
US-20120135994-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2012-05-31 US disclosed
US-8138195-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2012-03-20 US disclosed
US-8138195-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2012-03-20 US disclosed
EP-1438052-B1 QUINAZOLIN-4-ONES AS INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORP (US) 2010-12-29 EP disclosed
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-07-01 US disclosed
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-06-17 US disclosed
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-06-17 US 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 (10 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-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885
US-20120135994-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885
US-11459306-B2 Compounds, compositions, and methods for treating T-cell acute lymphoblastic leukemia BCL9, BCL3, MCL1 PIK3CD 15/4885PIK3R1 28/4885PIK3CG 11/4885
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885
US-20200061062-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885
US-20200165211-A1 Compounds, Compositions, and Methods for Treating T-Cell Acute Lymphoblastic Leukemia BCL9, BCL3, MCL1 PIK3CD 15/4885PIK3R1 28/4885PIK3CG 11/4885
US-10695349-B2 Inhibitors of human phosphatidylinositol 3-kinase delta PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885
US-10010550-B2 Inhibitors of human phosphatidylinositol 3-kinase delta PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885
US-10398695-B2 Inhibitors of human phosphatidylinositol 3-kinase delta PIK3CD, PIK3CA, PIK3CG PIK3CD 1/4885PIK3R1 12/4885PIK3CG 3/4885

“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.