SCHEMBL16625002

SCHEMBL16625002

CC(C)NC[C@@H](C(=O)O)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.55
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
BLM P54132 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
ADRB2 P07550 1/20 0.48
GAA P10253 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
NFKB1 P19838 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL22288404 1.00 POLB (0.55) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL683279 0.87 BRD4 (0.47) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL684403 0.87 BRD4 (0.47) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL684107 0.87 BRD4 (0.47) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL8224207 0.85 L3MBTL1 (0.43) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL2738632 0.85 L3MBTL1 (0.43) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL2738475 0.85 L3MBTL1 (0.43) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL679619 0.85 AKT1 (0.43) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL680689 0.85 AKT1 (0.43) POLBKMT2AMEN1KDM4EMAPT
SCHEMBL680930 0.85 AKT1 (0.43) POLBKMT2AMEN1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115485276-B Deuterated AKT kinase inhibitors 南京正大天晴制药有限公司 2024-05-31 CN disclosed
CN-117964620-A AKT inhibitors 南京正大天晴制药有限公司 2024-05-03 CN disclosed
CN-113272304-B AKT inhibitors 南京正大天晴制药有限公司 2024-03-29 CN disclosed
CN-115485276-A Deuterated AKT kinase inhibitors 南京正大天晴制药有限公司 2022-12-16 CN disclosed
CN-113272304-A AKT inhibitors 南京正大天晴制药有限公司 2021-08-17 CN disclosed
WO-2020156437-A1 AKT INHIBITOR 南京正大天晴制药有限公司 2020-08-06 WO disclosed
EP-2850054-B1 PROCESS FOR MAKING AMINO ACID COMPOUNDS GENENTECH INC (US) 2018-03-21 EP disclosed
US-9790190-B2 Process for making hydroxylated cyclopentylpyrimidine compounds ARRAY BIOPHARMA INC. (US) 2017-10-17 US disclosed
US-9790190-B2 Process for making hydroxylated cyclopentylpyrimidine compounds ARRAY BIOPHARMA INC. (US) 2017-10-17 US disclosed
US-20170247337-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS ARRAY BIOPHARMA INC. (US) 2017-08-31 US disclosed
US-9416110-B2 Process for making hydroxylated cyclopentylpyrimidine compounds ARRAY BIOPHARMA INC. (US) 2016-08-16 US disclosed
EP-2861582-B1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS ARRAY BIOPHARMA INC (US) 2016-05-25 EP disclosed
US-9315471-B2 Process of making hydroxylated cyclopentapyrimidine compounds and salts thereof GENETECH, INC. (US) 2016-04-19 US disclosed
US-9315471-B2 Process of making hydroxylated cyclopentapyrimidine compounds and salts thereof GENETECH, INC. (US) 2016-04-19 US disclosed
US-9278917-B2 Process for making amino acid compounds GENENTECH, INC. (US) 2016-03-08 US disclosed
US-20150152067-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS GENENTECH, INC. 2015-06-04 US disclosed
US-20150152067-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS GENENTECH, INC. 2015-06-04 US disclosed
US-20150148559-A1 PROCESS FOR MAKING AMINO ACID COMPOUNDS GENENTECH, INC. (US) 2015-05-28 US disclosed
US-20150099880-A1 PROCESS OF MAKING HYDROXYLATED CYCLOPENTAPYRIMIDINE COMPOUNDS AND SALTS THEREOF GENETECH, INC. (US) 2015-04-09 US disclosed
US-20150099880-A1 PROCESS OF MAKING HYDROXYLATED CYCLOPENTAPYRIMIDINE COMPOUNDS AND SALTS THEREOF GENETECH, INC. (US) 2015-04-09 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 (4 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-20150152067-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS DPYD, DHPS, TYMP POLB 142/4885KMT2A 1876/4885MEN1 1432/4885
US-20150148559-A1 PROCESS FOR MAKING AMINO ACID COMPOUNDS MTOR, PIK3CA, AKT1S1 POLB 639/4885KMT2A 993/4885MEN1 1419/4885
US-20150099880-A1 PROCESS OF MAKING HYDROXYLATED CYCLOPENTAPYRIMIDINE COMPOUNDS AND SALTS THEREOF PIK3CA, PIK3CD, PIK3CG POLB 470/4885KMT2A 1856/4885MEN1 2738/4885
US-20170247337-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS DPYD, DHPS, TYMP POLB 142/4885KMT2A 1876/4885MEN1 1432/4885

“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.