SCHEMBL21361220

SCHEMBL21361220

COc1cc(-c2ccc(F)cc2)cc(C)c1C1C(=O)CC2(CCN(OC)CC2)CC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.37
CNR2 P34972 2/20 0.37
KIT P10721 5/20 0.35
PDE4B Q07343 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
CYP1A1 P04798 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP1B1 Q16678 2/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
MCHR1 Q99705 3/20 0.33
HTR7 P34969 1/20 0.32
HTR2C P28335 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 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
SCHEMBL21361215 0.94 PDE4B (0.35) CNR1CNR2KITPDE4BHCRTR1
SCHEMBL21361217 0.94 CNR1 (0.38) CNR1CNR2KITHCRTR1HCRTR2
SCHEMBL26035216 0.88 CNR1 (0.32) CNR1CNR2KITPDE4BHCRTR1
SCHEMBL21361303 0.87 CYP2D6 (0.41) CNR1CNR2SMN1; SMN2CYP1A2ALDH1A1
SCHEMBL21361272 0.86 ALDH1A1 (0.38) CNR1CNR2SMN1; SMN2MEN1ALDH1A1
SCHEMBL21361264 0.86 SLC6A9 (0.35) SMN1; SMN2PTGS1PTGS2MCHR1MEN1
SCHEMBL26035158 0.85 PDE4B (0.33) CNR1CNR2KITPDE4BHCRTR1
SCHEMBL21361288 0.85 P2RX7 (0.33) KIT
SCHEMBL21361273 0.84 HDAC2 (0.37) CNR1CNR2HCRTR1HCRTR2SMN1; SMN2
SCHEMBL21361258 0.84 HDAC2 (0.35) CNR1CNR2HCRTR1HCRTR2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3765445-B1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2023-08-30 EP disclosed
US-20210000113-A1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2021-01-07 US disclosed
WO-2019175117-A1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2019-09-19 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 (1 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-20210000113-A1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES CBR3, DDT, CBR1 CNR1 217/4885CNR2 329/4885KIT 4702/4885

“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.