SCHEMBL926142

SCHEMBL926142

CC1CC(=O)c2ncnc(N3CCN(C(=O)O)CC3)c21

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 15/20 0.39
AKT3 Q9Y243 11/20 0.39
AKT2 P31751 10/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
ACHE P22303 1/20 0.37
BACE1 P56817 1/20 0.37
PIK3CA P42336 1/20 0.35
PRKG1 Q13976 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PDGFRB P09619 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL17634051 1.00 AKT1 (0.39) AKT1AKT3AKT2CYP1A2CYP3A4
SCHEMBL192015 0.84 KIT (0.48) ALDH1A1
SCHEMBL192014 0.84 KIT (0.48) ALDH1A1
SCHEMBL12194049 0.84 HRH4 (0.41) CYP1A2CYP3A4ACHEBACE1MEN1
SCHEMBL16488552 0.82 JAK2 (0.39) AKT1AKT3AKT2CYP1A2CYP3A4
SCHEMBL19283120 0.82 AKT1 (0.34) AKT1AKT3AKT2MEN1KMT2A
SCHEMBL16624829 0.81 AKT3 (0.33) AKT1AKT3AKT2CYP1A2CYP3A4
SCHEMBL3939523 0.81 AKT1 (0.32) AKT1AKT3AKT2CYP1A2CYP3A4
SCHEMBL17629229 0.80 HTR2C (0.40) CYP1A2CYP3A4MEN1KMT2AKDM4E
SCHEMBL3663646 0.80 MAPT (0.43) AKT1AKT3AKT2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023109540-A1 HETEROCYCLIC COMPOUND WITH AKT KINASE INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 中国医药研究开发中心有限公司 2023-06-22 WO disclosed
EP-3626710-B1 PROCESS FOR PREPARING AN INTERMEDIATE IN THE SYNTHESIS OF (CYCLOPENTYL[D]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS HOFFMANN LA ROCHE (CH) 2022-02-16 EP disclosed
US-10870626-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds F. HOFFMAN-LA ROCHE AG (CH) 2020-12-22 US disclosed
CN-112062727-A Process for preparing (cyclopenta [ d ] pyrimidin-4-yl) piperazine compounds 豪夫迈·罗氏有限公司 2020-12-11 CN disclosed
CN-107001287-B Process for preparing (cyclopenta [ d ] pyrimidin-4-yl) piperazine compounds 豪夫迈·罗氏有限公司 2020-09-04 CN disclosed
EP-3626710-A1 PROCESSES FOR PREPARING (CYCLOPENTYL[D]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2020-03-25 EP disclosed
US-10457648-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds GENENTECH INC. (US) 2019-10-29 US disclosed
EP-3197875-B1 PROCESSES FOR PREPARING (CYCLOPENTYL[D]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS HOFFMANN LA ROCHE (CH) 2019-08-14 EP disclosed
US-20170247338-A1 PROCESS FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS F. HOFFMAN-LA ROCHE AG (CH) 2017-08-31 US disclosed
EP-3197875-A1 PROCESSES FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2017-08-02 EP disclosed
US-9409886-B2 Pyrimidyl cyclopentanes as AKT protein kinase inhibitors ARRAY BIOPHARMA INC. (US) 2016-08-09 US disclosed
US-20160152601-A9 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2016-06-02 US disclosed
WO-2016049414-A1 PROCESSES FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2016-03-31 WO disclosed
EP-2170863-B1 Pyrimido cyclopentanes useful for the treatment of inflammatory or hyperproliferative diseases ARRAY BIOPHARMA INC (US) 2015-09-02 EP disclosed
US-20150099881-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS GENETECH, INC. (US) 2015-04-09 US disclosed
US-20140080829-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS GENENTECH, INC. (US) 2014-03-20 US disclosed
US-8618097-B2 Pyrimidyl cyclopentanes as AKT protein kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2013-12-31 US disclosed
US-20110015204-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2011-01-20 US disclosed
EP-2170863-A2 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS Array Biopharma, Inc. (US) 2010-04-07 EP disclosed
WO-2009006567-A2 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-01-08 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 (7 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-20150099881-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS PIK3CA, DHPS, PIK3CD AKT1 24/4885AKT3 30/4885AKT2 19/4885
US-10870626-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds PAK5, CDK5, PPIP5K2 AKT1 114/4885AKT3 193/4885AKT2 96/4885
US-20140080829-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS TK1, PIK3CA, AKT1 AKT1 3/4885AKT3 8/4885AKT2 4/4885
US-20170247338-A1 PROCESS FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS PAK5, CDK5, PPIP5K2 AKT1 114/4885AKT3 193/4885AKT2 96/4885
US-20160152601-A9 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS TK1, PIK3CA, AKT1 AKT1 3/4885AKT3 8/4885AKT2 4/4885
US-10457648-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds PAK5, CDK5, PPIP5K2 AKT1 114/4885AKT3 193/4885AKT2 96/4885
US-20110015204-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS TK1, PIK3CA, AKT1 AKT1 3/4885AKT3 8/4885AKT2 4/4885

“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.