SCHEMBL17452136

SCHEMBL17452136

CCOC(=O)C(C)NNC

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
ALDH1A1 P00352 4/20 0.40
METAP2 P50579 8/20 0.39
METAP1 P53582 6/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALOX15 P16050 1/20 0.37
SOAT1 P35610 1/20 0.37
HPGD P15428 1/20 0.36
CAD P27708 1/20 0.35
MMP8 P22894 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TRPA1 O75762 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
SCHEMBL31251996 1.00 MGAM (0.42) MGAMGAASIMGAM2ALDH1A1
SCHEMBL805100 0.81
SCHEMBL864303 0.81
SCHEMBL804999 0.81
Hydrochloric Acid SCHEMBL4589404 0.79 MGAM (0.44) MGAMGAASIMGAM2ALDH1A1
Hydrochloric Acid SCHEMBL15156949 0.79 MGAM (0.44) MGAMGAASIMGAM2ALDH1A1
SCHEMBL31252142 0.78 MGAM (0.39) MGAMGAASIMGAM2ALDH1A1
SCHEMBL23264148 0.78
SCHEMBL11185813 0.78 MGAM (0.48) MGAMGAASIMGAM2ALDH1A1
SCHEMBL5814208 0.77 METAP2 (0.46) MGAMGAASIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239755-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-07-18 US disclosed
CN-107531673-B Herbicidal compounds 先正达参股股份有限公司 2020-12-08 CN disclosed
US-9944608-B2 Herbicidal pyridazinone derivatives SYNGENTA PARTICIPATIONS AG (CH) 2018-04-17 US disclosed
US-20170166535-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-06-15 US disclosed
WO-2016008816-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2016-01-21 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-20240239755-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES PNPO, WEE1, PDXK MGAM 461/4885GAA 1104/4885SI 2746/4885
US-20170166535-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES HPD, DDT, PDXK MGAM 662/4885GAA 426/4885SI 3292/4885

“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.