SCHEMBL4619087

SCHEMBL4619087

Cc1ccc(/C=C/S(=O)(=O)O)c(C)c1.NC(=O)c1ccc(Br)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
NPC1 O15118 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
HPGD P15428 3/20 0.36
RAB9A P51151 3/20 0.36
FLT1 P17948 3/20 0.36
FLT4 P35916 3/20 0.36
KDR P35968 3/20 0.36
DGAT1 O75907 1/20 0.36
MAPT P10636 2/20 0.35
PKM P14618 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
HSP90AA1 P07900 1/20 0.35
ALOX12 P18054 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 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
SCHEMBL27739070 1.00 CA12 (0.44) CA12CA9NPC1SMN1; SMN2HPGD
SCHEMBL4620075 0.88 FLT1 (0.43) NPC1SMN1; SMN2HPGDRAB9AFLT1
SCHEMBL27717788 0.86 ALDH1A1 (0.36) NPC1SMN1; SMN2HPGDRAB9AFLT1
SCHEMBL5419492 0.86 ALDH1A1 (0.36) NPC1SMN1; SMN2HPGDRAB9AFLT1
SCHEMBL5411577 0.85 CYP1A1 (0.41) CA12CA9NPC1SMN1; SMN2RAB9A
SCHEMBL27717766 0.85 CYP1A1 (0.41) CA12CA9NPC1SMN1; SMN2RAB9A
SCHEMBL27717778 0.81 CA12 (0.48) CA12CA9RAB9AFLT1FLT4
SCHEMBL4619057 0.81 CA12 (0.48) CA12CA9RAB9AFLT1FLT4
SCHEMBL4619090 0.81 FLT1 (0.48) NPC1SMN1; SMN2HPGDRAB9AFLT1
SCHEMBL4619085 0.81 FLT1 (0.48) NPC1SMN1; SMN2HPGDRAB9AFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101268042-A Styryl sulfonamides, their preparation and use as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2008-09-17 CN claimed
EP-1888519-A2 STYRYLSULFONAMIDES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-02-20 EP claimed
WO-2007054139-A2 STYRYLSULFONAMIDES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2007-05-18 WO claimed
US-7208526-B2 For example, (E)-2-(4-Chloro-phenyl)-ethenesulfonic acid 2,4-dichloro-benzoylamide; for use in the control or prevention of illnesses such as cancer; antitumor agents HOFFMANN-LA ROCHE INC. (US) 2007-04-24 US claimed
US-20060270874-A1 Styrylsulfonamides HOFFMANN-LA ROCHE INC. 2006-11-30 US claimed
CN-101268042-A Styryl sulfonamides, their preparation and use as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2008-09-17 CN disclosed
US-7208526-B2 For example, (E)-2-(4-Chloro-phenyl)-ethenesulfonic acid 2,4-dichloro-benzoylamide; for use in the control or prevention of illnesses such as cancer; antitumor agents HOFFMANN-LA ROCHE INC. (US) 2007-04-24 US disclosed
US-20060270874-A1 Styrylsulfonamides HOFFMANN-LA ROCHE INC. 2006-11-30 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-20060270874-A1 Styrylsulfonamides STS, SULT1E1, BRCA1 CA12 1869/4885CA9 771/4885NPC1 1099/4885

“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.