SCHEMBL165881

SCHEMBL165881

COC(=O)c1cccnc1NS(=O)(=O)Cc1ccccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 1/20 0.43
▸ GRM4 Q14833 1/20 0.43
▸ SLC22A12 Q96S37 1/20 0.42
▸ DHODH Q02127 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ SGMS2 Q8NHU3 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ POLB P06746 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.40
▸ SLC40A1 Q9NP59 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ SRC P12931 1/20 0.40
▸ PTK2 Q05397 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL165185 0.86 MAPT (0.46) RORCALDH1A1HPGDRAB9APOLB
SCHEMBL271411 0.85 GRM4 (0.43) RORCGRM4SLC22A12HDAC6ALDH1A1
SCHEMBL164521 0.84 ALDH1A1 (0.42) RORCALDH1A1HPGDRAB9APOLB
SCHEMBL167689 0.84 ALDH1A1 (0.56) GRM4ALDH1A1HPGDRAB9APOLB
SCHEMBL17260916 0.82 GRM4 (0.43) GRM4SLC22A12DHODHHDAC6SGMS2
SCHEMBL9957557 0.78 GRM4 (0.45) RORCGRM4SLC22A12SGMS2NFE2L2
SCHEMBL165699 0.76 GRM4 (0.38) RORCGRM4SLC22A12SGMS2NFE2L2
SCHEMBL271510 0.75 P2RX7 (0.41) —
SCHEMBL17260913 0.74 L3MBTL1 (0.48) SGMS2ALDH1A1KDM4EABL1SRC
SCHEMBL14575165 0.74 CNR2 (0.51) ALDH1A1HPGDRAB9APOLBKDM4E

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-2611815-A1 HERBICIDE-EFFECTIVE PYRIDYL KETOSULTAMS Bayer Intellectual Property GmbH (DE) 2013-07-10 — — EP disclosed
US-20120065065-A1 HERBICIDALLY ACTIVE PYRIDYLKETOSULTAMS BAYER CROPSCIENCE AG (DE) 2012-03-15 — — US disclosed
WO-2012028580-A1 HERBICIDE-EFFECTIVE PYRIDYL KETOSULTAMS BAYER CROPSCIENCE AG (DE) 2012-03-08 — — 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-20120065065-A1 HERBICIDALLY ACTIVE PYRIDYLKETOSULTAMS PDXK, CBR3, CBR1 RORC 3283/4885GRM4 354/4885SLC22A12 2895/4885

“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.

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