SCHEMBL21285089

SCHEMBL21285089

CC#Cc1cc(C)c(C2=C(OC(C)=O)CC3(CCN(C(C)=O)CC3)CC2=O)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.32
CYP1A2 P05177 6/20 0.32
CYP2C9 P11712 5/20 0.32
TSHR P16473 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
USP2 O75604 5/20 0.32
CYP2D6 P10635 5/20 0.32
ALDH1A1 P00352 5/20 0.32
MAPK1 P28482 3/20 0.32
CYP2C19 P33261 3/20 0.32
HSD17B10 Q99714 4/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 2/20 0.31
HPGD P15428 3/20 0.30
GPR183 P32249 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GAA P10253 1/20 0.30
CASP1 P29466 1/20 0.30
MMP1 P03956 1/20 0.30

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
SCHEMBL21343925 0.92 BTK (0.31)
SCHEMBL24092256 0.92 CYP2D6 (0.34) HIF1ACYP1A2CYP2C9TSHRMEN1
SCHEMBL21285100 0.91 HIF1A (0.33) HIF1ACYP1A2CYP2C9TSHRMEN1
SCHEMBL21285149 0.91
SCHEMBL23748403 0.91
SCHEMBL21285251 0.90 CYP2D6 (0.31) HIF1ACYP1A2CYP2C9TSHRMEN1
SCHEMBL24426506 0.90
SCHEMBL21285249 0.90 HIF1A (0.31) HIF1ACYP1A2CYP2C9TSHRMEN1
SCHEMBL21285253 0.89 HIF1A (0.30) HIF1ACYP1A2CYP2C9TSHRMEN1
SCHEMBL22907824 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542235-B2 Herbicidal 3-azaspiro[5.5] undecane-8, 10-dione compounds SYNGENTA PARTICIPATIONS AG (CH) 2023-01-03 US disclosed
US-11542235-B2 Herbicidal 3-azaspiro[5.5] undecane-8, 10-dione compounds SYNGENTA PARTICIPATIONS AG (CH) 2023-01-03 US disclosed
EP-3762378-B1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2022-05-18 EP disclosed
EP-3752490-B1 HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-12-15 EP disclosed
US-20210139432-A1 HERBICIDAL 3- AZASPIRO[5.5] UNDECANE-8, 10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-05-13 US disclosed
US-20210139432-A1 HERBICIDAL 3- AZASPIRO[5.5] UNDECANE-8, 10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-05-13 US disclosed
WO-2021018826-A1 CYCLIC DIONES AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2021-02-04 WO disclosed
WO-2019170745-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-09-12 WO disclosed
WO-2019158666-A1 HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-08-22 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-20210139432-A1 HERBICIDAL 3- AZASPIRO[5.5] UNDECANE-8, 10-DIONE COMPOUNDS DDT, DECR1, DHRS9 HIF1A 3139/4885CYP1A2 35/4885CYP2C9 377/4885
US-11542235-B2 Herbicidal 3-azaspiro[5.5] undecane-8, 10-dione compounds DDT, DECR1, DHRS9 HIF1A 3139/4885CYP1A2 35/4885CYP2C9 377/4885

“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.