SCHEMBL21361282

SCHEMBL21361282

Cc1cc(-c2ccc(F)cc2)cc(C)c1C1C(=O)CC2(CCN(C(=O)OC(C)(C)C)CC2)CC1=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 4/20 0.53
HDAC1 Q13547 3/20 0.53
MMP13 P45452 1/20 0.42
GPR119 Q8TDV5 5/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
JAK2 O60674 2/20 0.40
JAK1 P23458 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACACB O00763 2/20 0.38
USP30 Q70CQ3 1/20 0.38

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
SCHEMBL23748413 0.90 HDAC2 (0.48) HDAC2HDAC1MMP13PTPN2PTPN1
SCHEMBL21361249 0.87 HDAC2 (0.38) HDAC2HDAC1
SCHEMBL21361289 0.86 HDAC2 (0.42) HDAC2HDAC1MEN1KMT2A
SCHEMBL21344641 0.85 ACACB (0.42) HDAC2HDAC1GPR119MEN1KMT2A
SCHEMBL21361255 0.84 HDAC2 (0.42) HDAC2HDAC1
SCHEMBL21285092 0.83 GPR119 (0.42) HDAC2HDAC1GPR119ACACB
SCHEMBL21361254 0.83 RORC (0.40) HDAC2HDAC1MEN1KMT2A
SCHEMBL21361248 0.83 HDAC2 (0.37) HDAC2HDAC1
SCHEMBL21361252 0.83 HDAC2 (0.41) HDAC2HDAC1
SCHEMBL21361246 0.82 CYP3A4 (0.47) MEN1KMT2A

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 HDAC2 964/4885HDAC1 845/4885MMP13 4700/4885

“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.