SCHEMBL21296416

SCHEMBL21296416

CC(C)N1CCC(n2cc([N+](=O)[O-])cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.39
GSK3B P49841 3/20 0.38
DYRK1A Q13627 3/20 0.38
OGA O60502 8/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MET P08581 1/20 0.36
CLK2 P49760 1/20 0.36
CLK3 P49761 1/20 0.36
DRD4 P21917 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
MAPT P10636 1/20 0.35
MAP3K7 O43318 1/20 0.34
TAB1 Q15750 1/20 0.34
TBK1 Q9UHD2 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
SCHEMBL23038642 0.95 HRH3 (0.37) HRH3GSK3BDYRK1AOGAKDM4E
SCHEMBL22635529 0.84 OGA (0.33) OGAALDH1A1DRD4SIGMAR1MAPT
SCHEMBL1558099 0.84 SIRT6 (0.40) GSK3BDYRK1AALDH1A1CLK2CLK3
SCHEMBL174612 0.83 F2 (0.41) ALDH1A1TDP1DRD4SIGMAR1MAPT
SCHEMBL16196214 0.81 MEN1 (0.42) GSK3BDYRK1AALDH1A1DRD4SIGMAR1
SCHEMBL22648384 0.81 ALDH1A1 (0.40) GSK3BDYRK1AALDH1A1METDRD4
SCHEMBL16975385 0.81 ACHE (0.45) ALDH1A1MAPT
SCHEMBL16974776 0.81 ACHE (0.42) ALDH1A1DRD4SIGMAR1MAPT
SCHEMBL29258453 0.80 ALDH1A1 (0.34) HRH3KDM4EALDH1A1TDP1MAPT
SCHEMBL2184349 0.80 MAP3K7 (0.49) ALDH1A1METMAP3K7TAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260042750-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS LLC (US) 2026-02-12 US disclosed
US-12479833-B2 Heteroarylaminopyrimidine amide autophagy inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2025-11-25 US disclosed
CN-114072397-B Heteroaryl aminopyrimidinamide autophagy inhibitors and methods of use thereof 德西费拉制药有限责任公司 2025-03-28 CN disclosed
EP-4295846-A2 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF Deciphera Pharmaceuticals, LLC (US) 2023-12-27 EP disclosed
EP-3966206-B1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS LLC (US) 2023-08-09 EP disclosed
EP-3966206-B1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS LLC (US) 2023-08-09 EP disclosed
US-20230047915-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2023-02-16 US disclosed
US-20230047915-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2023-02-16 US disclosed
US-11518758-B2 Heteroarylaminopyrimidine amide autophagy inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2022-12-06 US disclosed
US-11518758-B2 Heteroarylaminopyrimidine amide autophagy inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2022-12-06 US disclosed
US-11479555-B2 Substituted 1,2-dihydro-3H-pyrazolo[3,4-D]pyrimidin-3-ones as inhibitors of WEE-1 kinase NEWAVE PHARMACEUTICAL INC. (US) 2022-10-25 US disclosed
US-11390611-B2 2022-07-19 US disclosed
EP-3966206-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF Deciphera Pharmaceuticals, LLC (US) 2022-03-16 EP disclosed
CN-114072397-A Heteroaryl aminopyrimidine amide autophagy inhibitors and methods of use thereof 德西费拉制药有限责任公司 2022-02-18 CN disclosed
US-20210061807-A1 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDINE-3-ONE COMPOUNDS AS INHIBITORS OF WEE-1 KINASE NEWAVE PHARMACEUTICAL INC. 2021-03-04 US disclosed
US-20200354346-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2020-11-12 US disclosed
US-20200354346-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2020-11-12 US disclosed
WO-2019165204-A1 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDINE-3-ONE COMPOUNDS AS INHIBITORS OF WEE-1 KINASE NEWAVE PHARMACEUTICAL INC. (US) 2019-08-29 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 (8 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-20210061807-A1 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDINE-3-ONE COMPOUNDS AS INHIBITORS OF WEE-1 KINASE WEE1, WEE2, PEAK1 HRH3 1512/4885GSK3B 535/4885DYRK1A 301/4885
US-20230047915-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 HRH3 2287/4885GSK3B 1474/4885DYRK1A 2573/4885
US-12479833-B2 Heteroarylaminopyrimidine amide autophagy inhibitors and methods of use thereof BECN1, SQSTM1, ATG7 HRH3 2287/4885GSK3B 1474/4885DYRK1A 2573/4885
US-11479555-B2 Substituted 1,2-dihydro-3H-pyrazolo[3,4-D]pyrimidin-3-ones as inhibitors of WEE-1 kinase WEE1, WEE2, PHKG1 HRH3 1435/4885GSK3B 562/4885DYRK1A 301/4885
US-11390611-B2 BECN1, TFEB, SQSTM1 HRH3 3939/4885GSK3B 681/4885DYRK1A 4232/4885
US-20200354346-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 HRH3 2287/4885GSK3B 1474/4885DYRK1A 2573/4885
US-11518758-B2 Heteroarylaminopyrimidine amide autophagy inhibitors and methods of use thereof BECN1, SQSTM1, ATG7 HRH3 2287/4885GSK3B 1474/4885DYRK1A 2573/4885
US-20260042750-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, ATG7, SQSTM1 HRH3 1704/4885GSK3B 362/4885DYRK1A 2426/4885

“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.