SCHEMBL4164065

SCHEMBL4164065

Cc1onc(C(C)NS(=O)(=O)c2ccc(Cl)cc2)c1I

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 8/20 0.60
EDNRB P24530 2/20 0.44
EDNRA P25101 2/20 0.44
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MMP2 P08253 4/20 0.40
MMP1 P03956 2/20 0.40
MMP3 P08254 2/20 0.40
MMP7 P09237 2/20 0.40
MMP9 P14780 2/20 0.40
MMP13 P45452 2/20 0.40
NR3C1 P04150 1/20 0.40
MMP8 P22894 1/20 0.40
MMP14 P50281 1/20 0.40
CA12 O43570 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 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
SCHEMBL4164417 0.85 S1PR1 (0.60) S1PR1EDNRBEDNRAKMT2AMEN1
SCHEMBL3889414 0.84 S1PR1 (0.77) S1PR1KMT2ACA2
SCHEMBL4373065 0.79 S1PR1 (0.56) S1PR1MMP2CA2
SCHEMBL4156956 0.79 S1PR1 (0.56) S1PR1MMP2CA2
SCHEMBL13875332 0.77 S1PR1 (0.60) S1PR1KMT2AMMP2MMP1MMP3
SCHEMBL4169726 0.75 S1PR1 (1.00) S1PR1KMT2ACA2
SCHEMBL3885555 0.74 S1PR1 (0.53) S1PR1EDNRBEDNRAKMT2AMEN1
SCHEMBL13875329 0.72 S1PR1 (0.77) S1PR1KMT2ACA2
SCHEMBL3892610 0.72 S1PR1 (0.72) S1PR1KMT2AMMP2MMP1MMP3
SCHEMBL3887084 0.70 S1PR1 (0.69) S1PR1KMT2A

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
US-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-30 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-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ADGRE5, ADGRF1, SELPLG S1PR1 677/4885EDNRB 5/4885EDNRA 4/4885

“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.