SCHEMBL271644

SCHEMBL271644

COC(=O)c1nccnc1NS(=O)(=O)Cc1cc(Cl)ccc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.42
HTT P42858 1/20 0.40
DDR1 Q08345 4/20 0.39
P2RX7 Q99572 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
NOTUM Q6P988 2/20 0.36
CCR2 P41597 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.36
GAA P10253 1/20 0.36
S1PR4 O95977 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90B1 P14625 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
SCHEMBL271551 0.92 MRGPRX4 (0.45) MRGPRX4HTTDDR1P2RX7MAPT
SCHEMBL271329 0.88 MAPT (0.38) MRGPRX4MAPTNOTUMGAA
SCHEMBL270928 0.88 NOTUM (0.35) MRGPRX4MAPTNOTUM
SCHEMBL271678 0.85 S1PR4 (0.42) MRGPRX4PKMGAAS1PR4
SCHEMBL271411 0.85 GRM4 (0.43) HTTPTGDR2GAAHSP90AA1HSP90B1
SCHEMBL271510 0.83 P2RX7 (0.41) MRGPRX4P2RX7HSP90AA1HSP90B1
SCHEMBL270266 0.82 MCL1 (0.41) MRGPRX4DDR1MAPTNOTUMGAA
SCHEMBL270825 0.82 POLQ (0.41) MAPTPTGDR2
SCHEMBL269850 0.81 NOTUM (0.39) MRGPRX4P2RX7NOTUMCCR2PTGDR2
SCHEMBL271267 0.81 NOTUM (0.37) MRGPRX4DDR1PKMNOTUMPTGDR2

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 1457/4885DDR1 4636/4885

“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.