SCHEMBL6196899

SCHEMBL6196899

O=S(=O)(CCl)Nc1ccc(F)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.64
PTGES2 Q9H7Z7 2/20 0.44
TLR4 O00206 4/20 0.42
TSHR P16473 2/20 0.41
MEN1 O00255 1/20 0.41
ACLY P53396 1/20 0.40
CA2 P00918 2/20 0.40
CA1 P00915 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HPGD P15428 1/20 0.39
MCL1 Q07820 1/20 0.39
PYGL P06737 1/20 0.39
NAMPT P43490 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL287786 0.82 KMT2A (0.59) KMT2APTGES2TLR4
SCHEMBL8521457 0.81 KMT2A (0.48) KMT2APTGES2ACLYCA2CA1
SCHEMBL22315270 0.80 KMT2A (0.59) KMT2APTGES2TSHRMEN1ACLY
SCHEMBL16492686 0.79 KMT2A (0.55) KMT2ATLR4TSHRMEN1ACLY
SCHEMBL27182630 0.77 KMT2A (0.54) KMT2ATLR4TSHRMEN1ACLY
SCHEMBL10344599 0.77 ALDH1A1 (0.49) KMT2ACA2CA1NPC1RAB9A
SCHEMBL22315384 0.76 MCL1 (0.54) KMT2ATSHRMEN1ACLYCA2
SCHEMBL20290537 0.75 KMT2A (0.51) KMT2APTGES2TLR4TSHRMEN1
SCHEMBL19997238 0.75 KMT2A (0.51) KMT2ATLR4TSHRMEN1ACLY
SCHEMBL22315132 0.73 MEN1 (0.67) KMT2ATSHRMEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0973739-B1 N-ARYLSULFONAMIDE- AND PYRROLIDINECARBOXYLIC ACID INTERMEDIATES, AND THEIR USE FOR THE PREPARATION OF HERBICIDAL 1,3-DIOXO-1H-PYRROLO[1,2-C]IMIDAZOLE DERIVATIVES DEGUSSA (DE) 2005-11-02 EP disclosed
US-6664400-B2 1-((4-halo-3-sulfonamidophenyl)aminocarbonyl),2-carboxy -pyrrolidine intermediate of given formula DEGUSSA AG (DE) 2003-12-16 US disclosed
US-20020137946-A1 N-arylsulfonamide and pyrrolidinecarboxylic acid intermediates, and their use for the preparation of herbicidal 1,3-dioxo-1h-pyrrolo[1,2-c]imidazole derivatives DEGUSSA AG (DE) 2002-09-26 US disclosed
US-6384234-B1 HALOGENATION DEGUSSA AG (DE) 2002-05-07 US disclosed
EP-0973739-A1 N-ARYLSULFONAMIDE- AND PYRROLIDINECARBOXYLIC ACID INTERMEDIATES, AND THEIR USE FOR THE PREPARATION OF HERBICIDAL 1,3-DIOXO-1H-PYRROLO[1,2-C]IMIDAZOLE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-01-26 EP disclosed
WO-1998037065-A1 N-ARYLSULFONAMIDE- AND PYRROLIDINECARBOXYLIC ACID INTERMEDIATES, AND THEIR USE FOR THE PREPARATION OF HERBICIDAL 1,3-DIOXO-1H-PYRROLO[1,2-C]IMIDAZOLE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-08-27 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-20020137946-A1 N-arylsulfonamide and pyrrolidinecarboxylic acid intermediates, and their use for the preparation of herbicidal 1,3-dioxo-1h-pyrrolo[1,2-c]imidazole derivatives CBR3, CBR1, CLIC1 KMT2A 2863/4885PTGES2 3525/4885TLR4 2517/4885

“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.