SCHEMBL20544102

SCHEMBL20544102

Nc1ncc(C=NO)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 5/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.37
ACHE P22303 3/20 0.36
KDM4E B2RXH2 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
RIPK1 Q13546 1/20 0.33
HTT P42858 3/20 0.33
HSP90AA1 P07900 1/20 0.32

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
SCHEMBL9901402 0.76 NPC1 (0.46) NPC1RAB9AALDH1A1KMT2AMAPT
SCHEMBL9901401 0.76 NPC1 (0.46) NPC1RAB9AALDH1A1KMT2AMAPT
SCHEMBL27503360 0.76 ALDH1A1 (0.40) NPC1RAB9AALDH1A1KMT2AMAPT
SCHEMBL1095279 0.70
SCHEMBL1095276 0.70
SCHEMBL5433410 0.67
SCHEMBL528074 0.67
SCHEMBL4320351 0.67 NPC1 (0.46) NPC1RAB9AALDH1A1KMT2AMAPT
SCHEMBL506938 0.67 RAB9A (0.46) NPC1RAB9AALDH1A1KMT2AMAPT
SCHEMBL2358163 0.67 NPC1 (0.54) NPC1RAB9AALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108601351-B 2-amino-5-ketoxime-pyrimidine derivatives and their use for controlling undesired vegetation 拜耳作物科学股份公司 2020-12-11 CN disclosed
CN-108601351-B 2-amino-5-ketoxime-pyrimidine derivatives and their use for controlling undesired vegetation 拜耳作物科学股份公司 2020-12-11 CN disclosed
US-10806142-B2 2-amino-5-ketoxime-pyrimidine derivatives and their use for controlling undesired plant growth BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-10-20 US disclosed
US-10806142-B2 2-amino-5-ketoxime-pyrimidine derivatives and their use for controlling undesired plant growth BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-10-20 US disclosed
EP-3606915-A1 2-AMINO-5-OXYALKYL-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH Bayer CropScience Aktiengesellschaft (DE) 2020-02-12 EP disclosed
US-20200029565-A1 2-AMINO-5-OXYALKYL-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH BAYER AKTIENGESELLSCHAFT (DE) 2020-01-30 US disclosed
EP-3393244-B1 2-AMINO-5-KETOXIM PYRIMIDINE DERIVATIVES AND USE THEREOF FOR COMBATING UNDESIRED PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2019-12-18 EP disclosed
CN-110461833-A 2- amino -5- oxygroup alkyl derivative and its purposes for preventing and treating undesirable plant growth BAYER CROPSCIENCE AG 2019-11-15 CN disclosed
US-20190082692-A1 2-AMINO-5-KETOXIME-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-03-21 US disclosed
EP-3393244-A1 2-AMINO-5-KETOXIME-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH Bayer CropScience Aktiengesellschaft (DE) 2018-10-31 EP disclosed
CN-108601351-A 2-amino-5-ketoxime-pyrimidine derivatives and their use for controlling undesired vegetation 拜耳作物科学股份公司 2018-09-28 CN disclosed
CN-108601351-A 2-amino-5-ketoxime-pyrimidine derivatives and their use for controlling undesired vegetation 拜耳作物科学股份公司 2018-09-28 CN 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-20200029565-A1 2-AMINO-5-OXYALKYL-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH PFAS, ODC1, GART NPC1 4345/4885RAB9A 1927/4885ALDH1A1 1679/4885
US-20190082692-A1 2-AMINO-5-KETOXIME-PYRIMIDINE DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH TKT, TYMS, TK2 NPC1 4757/4885RAB9A 2907/4885ALDH1A1 1325/4885
US-10806142-B2 2-amino-5-ketoxime-pyrimidine derivatives and their use for controlling undesired plant growth TKT, TYMS, TK2 NPC1 4757/4885RAB9A 2907/4885ALDH1A1 1325/4885

“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.