SCHEMBL22992248

SCHEMBL22992248

CC#Cc1cc(C)c(C2C(=O)CC3(CCN(C(=O)NC(=O)c4ccc(F)cn4)CC3)CC2=O)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.35
BACE1 P56817 10/20 0.33
BACE2 Q9Y5Z0 7/20 0.33
APP P05067 1/20 0.32
GPR6 P46095 1/20 0.32
GRM5 P41594 4/20 0.32
KCNH2 Q12809 1/20 0.32
GRM4 Q14833 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
SCHEMBL21344680 0.92 NAMPT (0.35) BACE1BACE2GPR6
SCHEMBL21344694 0.91 BACE1 (0.33) BACE1BACE2APP
SCHEMBL22992072 0.90 TRPV1 (0.36) BACE1BACE2APP
SCHEMBL21344698 0.89 BACE1 (0.36) BACE1BACE2
SCHEMBL21343897 0.89 CYP1A2 (0.35) BACE1BACE2GPR6
SCHEMBL21344693 0.89 ALDH1A1 (0.32)
SCHEMBL22942059 0.87 RAB9A (0.35) KCNH2GRM4
SCHEMBL21344692 0.85 CLK1 (0.33) IRAK4GRM4
SCHEMBL21344695 0.84 TRPV1 (0.36) BACE1GPR6GRM5
SCHEMBL21343728 0.83 CYP3A4 (0.31)

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
US-12043599-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2024-07-23 US disclosed
EP-3762378-B1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2022-05-18 EP disclosed
US-20210047274-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-02-18 US 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 (2 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-20210047274-A1 HERBICIDAL COMPOUNDS DDT, CBR3, GLRX3 IRAK4 4128/4885BACE1 2863/4885BACE2 1789/4885
US-12043599-B2 Herbicidal compounds DDT, CBR3, GLRX3 IRAK4 4128/4885BACE1 2863/4885BACE2 1789/4885

“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.