SCHEMBL7366794

SCHEMBL7366794

O=C1CC(=O)CC2(CCNCC2)C1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NEK2 P51955 1/20 0.35
TSHR P16473 2/20 0.32
CYP2D6 P10635 2/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP3A4 P08684 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
SCHEMBL10068052 0.90 NEK2 (0.38) NEK2TSHRCYP2D6USP2ALDH1A1
Hydrochloric Acid SCHEMBL25351354 0.87 NEK2 (0.37) NEK2TSHRCYP2D6USP2ALDH1A1
SCHEMBL287483 0.81 ESR2 (0.34)
Oxalic Acid SCHEMBL30335525 0.79 CYP1A2 (0.36) NEK2TSHRCYP2D6USP2CYP3A4
SCHEMBL4450929 0.78 NEK2 (0.34) NEK2TSHRCYP2D6USP2ALDH1A1
SCHEMBL25726486 0.78 NEK2 (0.34) NEK2TSHRCYP2D6USP2ALDH1A1
SCHEMBL2527186 0.77 NEK2 (0.41) NEK2TSHRCYP2D6USP2ALDH1A1
SCHEMBL30690319 0.76 ALDH1A1 (0.31) ALDH1A1
Hydrochloric Acid SCHEMBL5249983 0.76 NEK2 (0.33) NEK2TSHR
SCHEMBL486771 0.76 ESR2 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111868033-B Herbicidal 3-azaspiro [5.5] undecane-8, 10-dione compounds 先正达参股股份有限公司 2024-01-30 CN disclosed
CN-111868033-B Herbicidal 3-azaspiro [5.5] undecane-8, 10-dione compounds 先正达参股股份有限公司 2024-01-30 CN disclosed
US-11542235-B2 Herbicidal 3-azaspiro[5.5] undecane-8, 10-dione compounds SYNGENTA PARTICIPATIONS AG (CH) 2023-01-03 US disclosed
US-20220117228-A1 SUBSTITUTED AZASPIRO-CYCLES AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2022-04-21 US disclosed
EP-3752490-B1 HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-12-15 EP disclosed
EP-3752490-A1 HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2020-12-23 EP disclosed
EP-3752490-A1 HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2020-12-23 EP disclosed
WO-2019158666-A1 HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-08-22 WO disclosed
WO-2019158666-A1 HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-08-22 WO disclosed
EP-0854869-A1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION ELI LILLY AND COMPANY (US) 1998-07-29 EP disclosed
WO-1997011940-A1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION ELI LILLY AND COMPANY (US) 1997-04-03 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-11542235-B2 Herbicidal 3-azaspiro[5.5] undecane-8, 10-dione compounds DDT, DECR1, DHRS9 NEK2 2834/4885TSHR 1601/4885CYP2D6 669/4885
US-20220117228-A1 SUBSTITUTED AZASPIRO-CYCLES AS HERBICIDES DDT, DHFR, CCNB3 NEK2 3015/4885TSHR 1160/4885CYP2D6 240/4885

“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.