SCHEMBL21361217

SCHEMBL21361217

CON1CCC2(CC1)CC(=O)C(c1c(C)cc(-c3ccc(F)cc3)cc1C)C(=O)C2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.38
CNR2 P34972 2/20 0.38
MCHR1 Q99705 3/20 0.34
KIT P10721 4/20 0.33
TNKS2 Q9H2K2 1/20 0.32
HDAC2 Q92769 4/20 0.32
HDAC1 Q13547 2/20 0.32
PTGS1 P23219 2/20 0.32
PTGS2 P35354 2/20 0.32
SSTR5 P35346 1/20 0.32
OTUD7B Q6GQQ9 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
BACE1 P56817 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
SCHEMBL21361220 0.94 CNR1 (0.37) CNR1CNR2MCHR1KITPTGS1
SCHEMBL21361215 0.89 PDE4B (0.35) CNR1CNR2KITPTGS1PTGS2
SCHEMBL21357809 0.84 P2RX7 (0.32)
SCHEMBL21361289 0.83 HDAC2 (0.42) HDAC2HDAC1
SCHEMBL22859582 0.83 FFAR4 (0.32)
SCHEMBL21361254 0.83 RORC (0.40) HDAC2HDAC1
SCHEMBL21361246 0.82 CYP3A4 (0.47)
SCHEMBL21361312 0.82 PTGS2 (0.35) MCHR1PTGS1PTGS2SSTR5
SCHEMBL22954988 0.82 CNR1 (0.38) CNR1CNR2MCHR1HDAC2HDAC1
SCHEMBL26035216 0.81 CNR1 (0.32) CNR1CNR2MCHR1KITPTGS1

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 329/4885MCHR1 1773/4885

“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.