SCHEMBL272015

SCHEMBL272015

COC(=O)c1nccnc1N(CC(F)F)S(=O)(=O)Cc1cc(Cl)ccc1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.36
HTT P42858 1/20 0.35
P2RX7 Q99572 1/20 0.34
FAAH O00519 5/20 0.33
DDR1 Q08345 4/20 0.33
MGLL Q99685 1/20 0.33
NOTUM Q6P988 1/20 0.32
GAA P10253 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90B1 P14625 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
SCHEMBL272180 0.90 NOTUM (0.33) NOTUMMAPT
SCHEMBL271739 0.90 MAPT (0.34) NOTUMGAAMAPT
SCHEMBL270522 0.90 MRGPRX4 (0.38) MRGPRX4HTTP2RX7DDR1GAA
SCHEMBL270665 0.87 BMP1 (0.38) HTTHSP90AA1HSP90B1
SCHEMBL271974 0.87 MRGPRX4 (0.35) MRGPRX4HTTP2RX7DDR1PTGDR2
SCHEMBL272014 0.86 NR1H2 (0.40) P2RX7
SCHEMBL269838 0.85 POLQ (0.38) PTGDR2MAPT
SCHEMBL271420 0.84 P2RX7 (0.34) P2RX7NOTUMPTGDR2MAPTHSP90AA1
SCHEMBL271755 0.84 MAPT (0.41) MRGPRX4MAPT
SCHEMBL270767 0.84 NOTUM (0.34) NOTUM

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-2220056-B1 HERBICIDAL COMPOUNDS SYNGENTA LTD (GB) 2015-09-30 EP disclosed
US-8133849-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2012-03-13 US disclosed
US-20100323889-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-12-23 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-20100323889-A1 HERBICIDAL COMPOUNDS CBR3, DDT, CBR1 MRGPRX4 1864/4885HTT 1457/4885P2RX7 1479/4885

“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.