SCHEMBL369408

SCHEMBL369408

C[C@H](Nc1nc(N)ncc1Cl)c1cc2cccc(Cl)c2nc1-c1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 1.00
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
BCL6 P41182 1/20 0.38
MAPK14 Q16539 4/20 0.35
LIMK1 P53667 1/20 0.35
LIMK2 P53671 1/20 0.35
PIK3R1 P27986 1/20 0.35
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34

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
SCHEMBL369409 1.00 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CGBCL6
SCHEMBL22476049 0.83 PIK3CD (1.00) PIK3CDPIK3CAPIK3CB
SCHEMBL19344355 0.83 PIK3CD (1.00) PIK3CDPIK3CAPIK3CB
SCHEMBL29869061 0.83 PIK3CD (1.00) PIK3CDPIK3CAPIK3CB
SCHEMBL6985484 0.80 PIK3CD (0.67) PIK3CDPIK3CG
SCHEMBL4566190 0.80 PIK3CD (0.67) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL4174170 0.80 PIK3CD (0.67) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL16585318 0.79 PIK3CD (0.64) PIK3CDMAPK14ADORA2AADORA1
SCHEMBL1313525 0.79 PIK3CD (0.64) PIK3CDMAPK14ADORA2AADORA1
SCHEMBL6986600 0.78 PIK3CD (0.65) PIK3CDPIK3CGBCL6MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-05-09 US claimed
WO-2012009452-A1 THE ROLE OF P13K P110 DELTA SIGNALING IN RETROVIRAL INFECTION AND REPLICATION PHILADELPHIA HEALTH & EDUCATION CORPORATION (US) 2012-01-19 WO claimed
US-9949979-B2 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2018-04-24 US disclosed
US-9949979-B2 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2018-04-24 US disclosed
US-20150342951-A1 Use of Inhibitors of the Activity or Function of PI3K NOVARTIS AG (CH) 2015-12-03 US disclosed
US-20150342951-A1 Use of Inhibitors of the Activity or Function of PI3K NOVARTIS AG (CH) 2015-12-03 US disclosed
EP-2139882-B1 3- SUBSTITUTED QUINOLINE OR QUINOXALINE DERIVATIVES AND THEIR USE AS PHOSPHATIDYLINOSITOL 3-KINASE (PI3K) INHIBITORS AMGEN INC (US) 2013-12-25 EP disclosed
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-05-09 US disclosed
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-05-09 US disclosed
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-05-09 US disclosed
US-8329910-B2 Quinolines for the treatment of PI3K-δ mediated diseases AMGEN INC. (US) 2012-12-11 US disclosed
WO-2010065923-A2 PHOSPHATIDYLINOSITOL-3-KINASE P110 DELTA-TARGETED DRUGS IN THE TREATMENT OF CNS DISORDERS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-06-10 WO disclosed
US-7705018-B2 Substituted quinolines and their uses in treatment of inflammatory and related conditions AMGEN INC. (US) 2010-04-27 US disclosed
US-7705018-B2 Substituted quinolines and their uses in treatment of inflammatory and related conditions AMGEN INC. (US) 2010-04-27 US disclosed
US-7705018-B2 Substituted quinolines and their uses in treatment of inflammatory and related conditions AMGEN INC. (US) 2010-04-27 US disclosed
EP-2139882-A1 3- SUBSTITUTED QUINOLINE OR QUINOXALINE DERIVATIVES AND THEIR USE AS PHOSPHATIDYLINOSITOL 3-KINASE ( PI3K) INHIBITORS Amgen Inc. (US) 2010-01-06 EP disclosed
US-20090023761-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-01-22 US disclosed
US-20090023761-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-01-22 US disclosed
US-20090023761-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-01-22 US disclosed
WO-2008118455-A1 δ3- SUBSTITUTED QUINOLINE OR QUINOXALINE DERIVATIVES AND THEIR USE AS PHOSPHATIDYLINOSITOL 3-KINASE ( PI3K) INHIBITORS 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 (3 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-20090023761-A1 Heterocyclic compounds and their uses MCL1, BCL9, MALT1 PIK3CD 16/4885PIK3CA 26/4885PIK3CB 35/4885
US-20150342951-A1 Use of Inhibitors of the Activity or Function of PI3K TLR9, PIK3CD, PIK3R5 PIK3CD 2/4885PIK3CA 8/4885PIK3CB 9/4885
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication PIK3R5, PIK3R4, PIK3R3 PIK3CD 6/4885PIK3CA 10/4885PIK3CB 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.