SCHEMBL2836068

SCHEMBL2836068

Cn1c(C(F)(F)F)cc(=O)n(-c2ccc(Cl)c(-c3nnnn3Cc3ccccc3)c2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 15/20 0.43
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.37
TRPA1 O75762 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL2835974 0.93 P2RX7 (0.43) P2RX7HTTL3MBTL1POLBALDH1A1
SCHEMBL2839349 0.89 BRD9 (0.38) P2RX7KMT2AALDH1A1
SCHEMBL2836047 0.88 ALDH1A1 (0.39) P2RX7ALDH1A1
SCHEMBL2839228 0.86 NOTUM (0.33) P2RX7KMT2A
SCHEMBL2837020 0.86 ALDH1A1 (0.44) HTTL3MBTL1POLBKMT2AALDH1A1
SCHEMBL2833127 0.85 RAB9A (0.39) P2RX7ALDH1A1
SCHEMBL2836856 0.85 NOTUM (0.33) P2RX7ALDH1A1
SCHEMBL2834932 0.85 NOTUM (0.32) P2RX7
SCHEMBL1573904 0.85 POLB (0.37) L3MBTL1POLBKMT2AALDH1A1
SCHEMBL2833836 0.85 NOTUM (0.37) L3MBTL1ALDH1A1

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
US-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US claimed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 US claimed
US-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US disclosed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 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 (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-20060025591-A1 New uracils having a herbicidal activity UNG, DDT, UMPS P2RX7 1440/4885HTT 2533/4885L3MBTL1 584/4885

“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.