SCHEMBL21361239

SCHEMBL21361239

Cc1cc(-c2ncc(F)cn2)cc(C)c1C1C(=O)CC2(CCN(C(=O)NC(=O)C(C)(C)C)CC2)CC1=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.33
SPR P35270 1/20 0.33
ALDH1A1 P00352 4/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
HDAC2 Q92769 3/20 0.32
HDAC1 Q13547 1/20 0.32
CYP3A4 P08684 2/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
KIT P10721 2/20 0.31
CNR2 P34972 1/20 0.31
CYP2D6 P10635 1/20 0.31
ACACB O00763 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
SCHEMBL21361253 0.89 SPR (0.36) SPRHDAC2HDAC1CYP3A4
SCHEMBL21361222 0.88 SPR (0.35) SPRALDH1A1HTTHDAC2HDAC1
SCHEMBL21361252 0.87 HDAC2 (0.41) ABL1ALDH1A1HDAC2HDAC1KIT
SCHEMBL24120306 0.86 ACACB (0.33) ABL1ACACB
SCHEMBL21357467 0.85 SPR (0.37) SPRALDH1A1KMT2ACYP3A4MEN1
SCHEMBL21361231 0.83 TNKS2 (0.36) ALDH1A1KMT2ALMNAHTTCYP3A4
SCHEMBL21361241 0.83 ALDH1A1 (0.37) SPRALDH1A1KMT2AMEN1
SCHEMBL21361242 0.82 SPR (0.35) SPRCYP3A4CYP2D6ACACB
SCHEMBL24120128 0.81 ABL1 (0.35) ABL1HDAC2HDAC1KIT
SCHEMBL21361261 0.81 HDAC2 (0.40) ALDH1A1HDAC2HDAC1CYP3A4TSHR

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 ABL1 2997/4885SPR 319/4885ALDH1A1 26/4885

“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.