SCHEMBL4375641

SCHEMBL4375641

O=C(NS(=O)(=O)c1cnc(Cl)c(Br)c1)c1ccc(F)cc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 8/20 0.51
FLT4 P35916 8/20 0.51
KDR P35968 8/20 0.51
EGFR P00533 4/20 0.45
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 1/20 0.45
HTT P42858 1/20 0.40
SCN9A Q15858 1/20 0.40
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39

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
SCHEMBL4372094 0.89 FLT1 (0.65) FLT1FLT4KDREGFRALDH1A1
SCHEMBL4370905 0.88 FLT1 (0.53) FLT1FLT4KDREGFRALDH1A1
SCHEMBL4368105 0.87 FLT1 (0.56) FLT1FLT4KDREGFRALDH1A1
SCHEMBL4382195 0.83 FLT1 (0.51) FLT1FLT4KDREGFRALDH1A1
SCHEMBL4375642 0.81 PSEN1 (0.38) ALDH1A1HTT
SCHEMBL4372513 0.80 FLT1 (0.67) FLT1FLT4KDREGFRALDH1A1
SCHEMBL4371550 0.78 FLT1 (0.70) FLT1FLT4KDRALDH1A1KMT2A
SCHEMBL4374095 0.78 FLT1 (0.70) FLT1FLT4KDR
SCHEMBL4371952 0.78 FLT1 (0.65) FLT1FLT4KDREGFRALDH1A1
SCHEMBL1206949 0.77 FLT1 (0.45) FLT1FLT4KDREGFRSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960361-A1 PYRIDYLSULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTINEOPLASTIC AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-08-27 EP claimed
WO-2007059872-A1 PYRIDYLSULFONAMIDE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTINEOPLASTIC AGENTS F. HOFFMNN-LA ROCHE AG (CH) 2007-05-31 WO claimed
US-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent HOFFMANN-LA ROCHE INC. 2007-05-31 US claimed
US-7625896-B2 Pyridylsulfonamide derivatives HOFFMAN-LA ROCHE INC. (US) 2009-12-01 US disclosed
US-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent HOFFMANN-LA ROCHE INC. 2007-05-31 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-20070123513-A1 6-thiomorpholin-4-yl-pyridine-3-sulfonic acid 4-chloro-2-methoxy-benzoylamide; ammonium salt of3-methyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-sulfonic acid 4-chloro-2-methoxy-benzoylamide; anticarcinogenic agent TPMT, BPNT1, SLC6A3 FLT1 4752/4885FLT4 4294/4885KDR 4767/4885

“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.