SCHEMBL2972089

SCHEMBL2972089

CC1(C)C(=O)NC(=O)N1CCNc1nccc(-c2ccc(Sc3ccccc3)s2)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT3 Q9Y243 4/20 0.35
CDK2 P24941 3/20 0.35
CLK1 P49759 1/20 0.35
EIF2AK2 P19525 3/20 0.34
MAPK3 P27361 1/20 0.34
MAPK1 P28482 1/20 0.34
MKNK1 Q9BUB5 4/20 0.32
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PIK3CA P42336 1/20 0.31
CCNT1 O60563 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK9 P50750 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
SLC6A2 P23975 1/20 0.31
HRH2 P25021 1/20 0.31
HTR1D P28221 1/20 0.31
HTR2A P28223 1/20 0.31

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
SCHEMBL2983838 0.90 PIK3CA (0.35) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2975266 0.89 CDK2 (0.35) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2983394 0.89 CDK2 (0.34) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2977663 0.89 AKT3 (0.33) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2975976 0.84 DKK1 (0.41) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2980883 0.83 AKT3 (0.41) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2990318 0.83 AKT3 (0.42) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2977023 0.83 AKT3 (0.35) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2977020 0.83 AKT3 (0.35) AKT3CDK2CLK1EIF2AK2MAPK3
SCHEMBL2982348 0.82 MEN1 (0.38) AKT3CDK2CLK1EIF2AK2MAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831207-B1 AMINOPYRIMIDINE COMPOUNDS AS PLK INHIBITORS AMGEN INC (US) 2012-11-14 EP claimed
US-7786132-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-08-31 US claimed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 US claimed
EP-1831207-B1 AMINOPYRIMIDINE COMPOUNDS AS PLK INHIBITORS AMGEN INC (US) 2012-11-14 EP disclosed
US-7858785-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-12-28 US disclosed
US-7786132-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-08-31 US disclosed
US-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-01-14 US disclosed
EP-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP disclosed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 US disclosed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 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-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE PLK1, TYMP, TK2 AKT3 920/4885CDK2 23/4885CLK1 363/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 AKT3 920/4885CDK2 23/4885CLK1 363/4885

“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.