SCHEMBL4920458

SCHEMBL4920458

CCC1COC(=O)N1Cc1ccccc1NS(=O)(=O)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.41
PTGS2 P35354 3/20 0.41
CA2 P00918 1/20 0.37
AR P10275 7/20 0.35
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
POLB P06746 1/20 0.33
P2RX7 Q99572 1/20 0.33
NR3C1 P04150 2/20 0.32
PGR P06401 2/20 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
SCHEMBL27694998 0.78 PPARA (0.34) ARP2RX7
SCHEMBL2576146 0.77 PTGS1 (0.38) PTGS1PTGS2CA2LTB4RLTB4R2
SCHEMBL4919757 0.76 PTGS1 (0.41) PTGS1PTGS2CA2
SCHEMBL4919572 0.75 PTGS1 (0.41) PTGS1PTGS2CA2LTB4RLTB4R2
SCHEMBL4918116 0.74 PTGS1 (0.39) PTGS1PTGS2CA2LTB4RLTB4R2
SCHEMBL4923566 0.74 SIRT2 (0.40) ARP2RX7
SCHEMBL4918196 0.72 PTGS1 (0.38) PTGS1PTGS2CA2
SCHEMBL2579885 0.72 GRIN1 (0.40) PTGS1PTGS2CA2POLB
SCHEMBL1964543 0.71 PTGS1 (0.40) PTGS1PTGS2CA2
SCHEMBL4920097 0.71 PTGS1 (0.40) PTGS1PTGS2CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080274892-A1 Novel Haloalkylsulfonanilide Derivative, Herbicide, and Method of Use Thereof NIHON NOHYAKU CO., LTD. (JP) 2008-11-06 US disclosed
EP-1852425-A1 NOVEL HALOALKYLSULFONANILIDE DERIVATIVE, HERBICIDE, AND METHOD OF USE THEREOF Nihon Nohyaku Co., Ltd. (JP) 2007-11-07 EP 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-20080274892-A1 Novel Haloalkylsulfonanilide Derivative, Herbicide, and Method of Use Thereof HDHD5, DDT, CBR3 PTGS1 3550/4885PTGS2 3734/4885CA2 948/4885

“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.