SCHEMBL21361291

SCHEMBL21361291

Cc1cc(-c2ccc(C#N)cn2)cc(C)c1C1C(=O)CC2(CCN(C(=O)C3CC3)CC2)CC1=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FASN P49327 10/20 0.37
PIK3CD O00329 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.36
ENPP2 Q13822 1/20 0.35
ATXN2 Q99700 1/20 0.35
ALK Q9UM73 1/20 0.35
ACACA Q13085 1/20 0.35
KDM1A O60341 2/20 0.35
KCNH2 Q12809 1/20 0.35
ABL1 P00519 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
TNKS O95271 1/20 0.34

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
SCHEMBL22908412 0.94 P2RX7 (0.36) FASNPIK3CDIRAK4ENPP2ATXN2
SCHEMBL22908420 0.93 PIK3CA (0.37) FASNPIK3CDIRAK4ENPP2ATXN2
SCHEMBL24120146 0.91 FASN (0.38) FASNIRAK4ENPP2ATXN2KDM1A
SCHEMBL21361283 0.91 CYP1A2 (0.41) FASNIRAK4ACACA
SCHEMBL22908449 0.90 PIK3CA (0.38) PIK3CDIRAK4ENPP2ATXN2ALK
SCHEMBL24324810 0.89 ACACA (0.35) FASNACACA
SCHEMBL21361287 0.89 IRAK4 (0.37) FASNIRAK4ACACA
SCHEMBL21361286 0.88 IRAK4 (0.36) FASNIRAK4ACACA
SCHEMBL21361223 0.88 JAK2 (0.37) FASNIRAK4ENPP2ATXN2
SCHEMBL24324819 0.87 FASN (0.35) FASNACACA

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 4 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
WO-2021018826-A1 CYCLIC DIONES AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2021-02-04 WO 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 FASN 1005/4885PIK3CD 2358/4885IRAK4 2073/4885

“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.